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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (12)
Phenols (8)
Unsubstituted Phenols (1)

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p-Nitro Blue Tetrazolium Chloride, Molecular Biology Reagent Grade, MP Biomedicals™

CAS: 298-83-9 Molecular Formula: C40H30Cl2N10O6 Molecular Weight (g/mol): 817.644 MDL Number: MFCD00012159 InChI Key: FSVCQIDHPKZJSO-UHFFFAOYSA-L Synonym: nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt PubChem CID: 9281 ChEBI: CHEBI:9505 IUPAC Name: 2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]

PubChem CID 9281
CAS 298-83-9
Molecular Weight (g/mol) 817.644
ChEBI CHEBI:9505
MDL Number MFCD00012159
SMILES COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]
Synonym nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt
IUPAC Name 2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride
InChI Key FSVCQIDHPKZJSO-UHFFFAOYSA-L
Molecular Formula C40H30Cl2N10O6
2

Rosmarinic Acid, 98.6%, MP Biomedicals™

CAS: 20283-92-5 Molecular Formula: C18H16O8 Molecular Weight (g/mol): 360.318 MDL Number: MFCD00017740 InChI Key: DOUMFZQKYFQNTF-WUTVXBCWSA-N Synonym: rosmarinic acid,rosemary acid,r-rosmarinic acid,unii-mqe6xg29yi,rosmarinate,mqe6xg29yi,labiatenic acid,r-o-3,4-dihydroxycinnamoyl-3-3,4-dihydroxyphenyl lactic acid,3,4-dihydroxycinnamic acid r-1-carboxy-2-3,4-dihydroxyphenyl ethyl ester,2r-3-3,4-dihydroxyphenyl-2-2e-3-3,4-dihydroxyphenyl prop-2-enoyloxy propanoic acid PubChem CID: 5281792 ChEBI: CHEBI:50371 IUPAC Name: (2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid SMILES: C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O

PubChem CID 5281792
CAS 20283-92-5
Molecular Weight (g/mol) 360.318
ChEBI CHEBI:50371
MDL Number MFCD00017740
SMILES C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
Synonym rosmarinic acid,rosemary acid,r-rosmarinic acid,unii-mqe6xg29yi,rosmarinate,mqe6xg29yi,labiatenic acid,r-o-3,4-dihydroxycinnamoyl-3-3,4-dihydroxyphenyl lactic acid,3,4-dihydroxycinnamic acid r-1-carboxy-2-3,4-dihydroxyphenyl ethyl ester,2r-3-3,4-dihydroxyphenyl-2-2e-3-3,4-dihydroxyphenyl prop-2-enoyloxy propanoic acid
IUPAC Name (2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid
InChI Key DOUMFZQKYFQNTF-WUTVXBCWSA-N
Molecular Formula C18H16O8
3

Resorcinol, MP Biomedicals™

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O

PubChem CID 5054
CAS 108-46-3
Molecular Weight (g/mol) 110.112
ChEBI CHEBI:27810
MDL Number MFCD00002269
SMILES C1=CC(=CC(=C1)O)O
Synonym resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
5

Hydridotetrakis(triphenylphosphine)rhodium(I)

CAS: 18284-36-1 Molecular Formula: C72H61P4Rh Molecular Weight (g/mol): 1153.08 MDL Number: MFCD00015867 InChI Key: QTTJMGBPWXLZKV-UHFFFAOYSA-N Synonym: hrh pph3 4,hydridotetrakis triphenylphosphine rhodium i,tetrakis triphenylphosphine rhodium hydride,tetrakis triphenylphosphine rhodium,tetrakis triphenylphosphine rhodium i hydride,molecular weight:456.19,molecular formula:c16h26o2rh2,cas number:73468-85-6,rhodium, tetrakis triphenylphosphine,hydridotetrakis triphenylphosphine rhodium PubChem CID: 11981874 IUPAC Name: tetrakis(triphenylphosphane) rhodium SMILES: [RhH].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11981874
CAS 18284-36-1
Molecular Weight (g/mol) 1153.08
MDL Number MFCD00015867
SMILES [RhH].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym hrh pph3 4,hydridotetrakis triphenylphosphine rhodium i,tetrakis triphenylphosphine rhodium hydride,tetrakis triphenylphosphine rhodium,tetrakis triphenylphosphine rhodium i hydride,molecular weight:456.19,molecular formula:c16h26o2rh2,cas number:73468-85-6,rhodium, tetrakis triphenylphosphine,hydridotetrakis triphenylphosphine rhodium
IUPAC Name tetrakis(triphenylphosphane) rhodium
InChI Key QTTJMGBPWXLZKV-UHFFFAOYSA-N
Molecular Formula C72H61P4Rh
6

Benzyltrimethylammonium tribromide, 98%

CAS: 111865-47-5 Molecular Formula: C10H17Br3N+ Molecular Weight (g/mol): 390.965 MDL Number: MFCD00134423 InChI Key: GSDDWZVWOXMLJZ-UHFFFAOYSA-N Synonym: benzyltrimethylammonium tribromide PubChem CID: 86222689 IUPAC Name: benzyl(trimethyl)azanium;molecular bromine;hydrobromide SMILES: C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr

PubChem CID 86222689
CAS 111865-47-5
Molecular Weight (g/mol) 390.965
MDL Number MFCD00134423
SMILES C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr
Synonym benzyltrimethylammonium tribromide
IUPAC Name benzyl(trimethyl)azanium;molecular bromine;hydrobromide
InChI Key GSDDWZVWOXMLJZ-UHFFFAOYSA-N
Molecular Formula C10H17Br3N+
7

4,5-Dihydroxy-1,3-benznedisulphonic acid disodium salt, 97.4%, MP Biomedicals™

CAS: 149-45-1 Molecular Formula: C6H10Na2O8S2 Molecular Weight (g/mol): 320.238 InChI Key: HEOKHLCODUWALT-UHFFFAOYSA-N Synonym: tiron,tiferron,sodium catechol sulfate,disodium 4,5-dihydroxybenzene-1,3-disulfonate,3,5-disulfocatechol disodium salt,sodium pyrocatechol-3,5-disulfonate,disodium pyrocatechol-3,5-disulfonate,sodium 1,2-dihydroxybenzenedisulfonate,1,2-dihydroxybenzene-3,5-disulfonic acid disodium salt,1,3-benzenedisulfonic acid, 4,5-dihydroxy-, disodium salt PubChem CID: 131674010 IUPAC Name: 4,5-dihydroxybenzene-1,3-disulfonic acid;molecular hydrogen;sodium SMILES: [HH].[HH].C1=C(C=C(C(=C1S(=O)(=O)O)O)O)S(=O)(=O)O.[Na].[Na]

PubChem CID 131674010
CAS 149-45-1
Molecular Weight (g/mol) 320.238
SMILES [HH].[HH].C1=C(C=C(C(=C1S(=O)(=O)O)O)O)S(=O)(=O)O.[Na].[Na]
Synonym tiron,tiferron,sodium catechol sulfate,disodium 4,5-dihydroxybenzene-1,3-disulfonate,3,5-disulfocatechol disodium salt,sodium pyrocatechol-3,5-disulfonate,disodium pyrocatechol-3,5-disulfonate,sodium 1,2-dihydroxybenzenedisulfonate,1,2-dihydroxybenzene-3,5-disulfonic acid disodium salt,1,3-benzenedisulfonic acid, 4,5-dihydroxy-, disodium salt
IUPAC Name 4,5-dihydroxybenzene-1,3-disulfonic acid;molecular hydrogen;sodium
InChI Key HEOKHLCODUWALT-UHFFFAOYSA-N
Molecular Formula C6H10Na2O8S2
8

Benzyltrimethylammonium tribromide, 97%

CAS: 111865-47-5 Molecular Formula: C10H16Br3N Molecular Weight (g/mol): 389.95 MDL Number: MFCD00134423 InChI Key: GSDDWZVWOXMLJZ-UHFFFAOYSA-N Synonym: benzyltrimethylammonium tribromide PubChem CID: 86222689 IUPAC Name: benzyl(trimethyl)azanium;molecular bromine;hydrobromide SMILES: C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr

PubChem CID 86222689
CAS 111865-47-5
Molecular Weight (g/mol) 389.95
MDL Number MFCD00134423
SMILES C[N+](C)(C)CC1=CC=CC=C1.Br.BrBr
Synonym benzyltrimethylammonium tribromide
IUPAC Name benzyl(trimethyl)azanium;molecular bromine;hydrobromide
InChI Key GSDDWZVWOXMLJZ-UHFFFAOYSA-N
Molecular Formula C10H16Br3N
9

Hydridotetrakis(triphenylphosphine)rhodium(I), Rh 8.9% min

CAS: 18284-36-1 Molecular Formula: C72H61P4Rh Molecular Weight (g/mol): 1153.08 MDL Number: MFCD00015867 InChI Key: QTTJMGBPWXLZKV-UHFFFAOYSA-N Synonym: hrh pph3 4,hydridotetrakis triphenylphosphine rhodium i,tetrakis triphenylphosphine rhodium hydride,tetrakis triphenylphosphine rhodium,tetrakis triphenylphosphine rhodium i hydride,molecular weight:456.19,molecular formula:c16h26o2rh2,cas number:73468-85-6,rhodium, tetrakis triphenylphosphine,hydridotetrakis triphenylphosphine rhodium PubChem CID: 11981874 SMILES: [RhH].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11981874
CAS 18284-36-1
Molecular Weight (g/mol) 1153.08
MDL Number MFCD00015867
SMILES [RhH].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym hrh pph3 4,hydridotetrakis triphenylphosphine rhodium i,tetrakis triphenylphosphine rhodium hydride,tetrakis triphenylphosphine rhodium,tetrakis triphenylphosphine rhodium i hydride,molecular weight:456.19,molecular formula:c16h26o2rh2,cas number:73468-85-6,rhodium, tetrakis triphenylphosphine,hydridotetrakis triphenylphosphine rhodium
InChI Key QTTJMGBPWXLZKV-UHFFFAOYSA-N
Molecular Formula C72H61P4Rh