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.

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2,041 – 2,055 of 78,691 results

2,041

4-Bromo-3-chlorophenol, 98%, Thermo Scientific Chemicals

CAS: 13631-21-5 Molecular Formula: C6H4BrClO Molecular Weight (g/mol): 207.451 MDL Number: MFCD00070744 InChI Key: FQEYHIPPYOSPLF-UHFFFAOYSA-N Synonym: phenol, 4-bromo-3-chloro,3-chloro-4-bromophenol,2-chloro-4-hydroxybromobenzene,pubchem3597,acmc-1bvpq,4-bromo-3-chloro-phenol,intermediates-zcf02051,ksc493i5n,4-bromanyl-3-chloranyl-phenol PubChem CID: 7018182 IUPAC Name: 4-bromo-3-chlorophenol SMILES: C1=CC(=C(C=C1O)Cl)Br

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Specifications

PubChem CID	7018182
CAS	13631-21-5
Molecular Weight (g/mol)	207.451
MDL Number	MFCD00070744
SMILES	C1=CC(=C(C=C1O)Cl)Br
Synonym	phenol, 4-bromo-3-chloro,3-chloro-4-bromophenol,2-chloro-4-hydroxybromobenzene,pubchem3597,acmc-1bvpq,4-bromo-3-chloro-phenol,intermediates-zcf02051,ksc493i5n,4-bromanyl-3-chloranyl-phenol
IUPAC Name	4-bromo-3-chlorophenol
InChI Key	FQEYHIPPYOSPLF-UHFFFAOYSA-N
Molecular Formula	C6H4BrClO

2,042

cis-Dichlorobis(triphenylphosphine)platinum(II), Pt 24.2% min

CAS: 15604-36-1 Molecular Formula: C36H30Cl2P2Pt Molecular Weight (g/mol): 790.57 MDL Number: MFCD00010825 InChI Key: ILIBUWCDNDIUOT-UHFFFAOYSA-L Synonym: cis-?dichlorobis triphenylphosphine ?platinum ii PubChem CID: 131667321 IUPAC Name: platinum(2+);triphenylphosphane;dihydrochloride SMILES: Cl[Pt++]Cl.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

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Specifications

PubChem CID	131667321
CAS	15604-36-1
Molecular Weight (g/mol)	790.57
MDL Number	MFCD00010825
SMILES	Cl[Pt++]Cl.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	cis-?dichlorobis triphenylphosphine ?platinum ii
IUPAC Name	platinum(2+);triphenylphosphane;dihydrochloride
InChI Key	ILIBUWCDNDIUOT-UHFFFAOYSA-L
Molecular Formula	C36H30Cl2P2Pt

2,043

Piceatannol, 96%, Thermo Scientific™

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2,044

2-Iodobiphenyl, 98%

CAS: 2113-51-1 Molecular Formula: C₁₂H₉I Molecular Weight (g/mol): 280.1 MDL Number: MFCD00039396 InChI Key: QFUYDAGNUJWBSM-UHFFFAOYSA-N Synonym: 2-iodobiphenyl,2-iodo-1,1'-biphenyl,o-iodobiphenyl,1,1'-biphenyl, 2-iodo,o-phenyliodobenzene,2-iodo-biphenyl,biphenyl, 2-iodo,2-iodo-1-phenylbenzene,1-iodo-2-phenyl-benzene,1,1'-biphenyl, iodo PubChem CID: 75025 IUPAC Name: 1-iodo-2-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC=CC=C2I

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Specifications

PubChem CID	75025
CAS	2113-51-1
Molecular Weight (g/mol)	280.1
MDL Number	MFCD00039396
SMILES	C1=CC=C(C=C1)C2=CC=CC=C2I
Synonym	2-iodobiphenyl,2-iodo-1,1'-biphenyl,o-iodobiphenyl,1,1'-biphenyl, 2-iodo,o-phenyliodobenzene,2-iodo-biphenyl,biphenyl, 2-iodo,2-iodo-1-phenylbenzene,1-iodo-2-phenyl-benzene,1,1'-biphenyl, iodo
IUPAC Name	1-iodo-2-phenylbenzene
InChI Key	QFUYDAGNUJWBSM-UHFFFAOYSA-N
Molecular Formula	C₁₂H₉I

2,045

(S)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee

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2,046

4-Bromophenylacetone, 97%

CAS: 6186-22-7 Molecular Formula: C24H24N2O5S Molecular Weight (g/mol): 452.53 MDL Number: MFCD00210401 InChI Key: CDUPPXGKUKTGLU-UHFFFAOYSA-N Synonym: 4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone PubChem CID: 736332 SMILES: COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1

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Specifications

PubChem CID	736332
CAS	6186-22-7
Molecular Weight (g/mol)	452.53
MDL Number	MFCD00210401
SMILES	COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1
Synonym	4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone
InChI Key	CDUPPXGKUKTGLU-UHFFFAOYSA-N
Molecular Formula	C24H24N2O5S

2,047

(R)-(-)-2-Phenylbutyric acid, 99%

CAS: 938-79-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00063165 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYNA-N Synonym: r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar PubChem CID: 785330 IUPAC Name: (2R)-2-phenylbutanoic acid SMILES: CCC(C(O)=O)C1=CC=CC=C1

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Specifications

PubChem CID	785330
CAS	938-79-4
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00063165
SMILES	CCC(C(O)=O)C1=CC=CC=C1
Synonym	r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar
IUPAC Name	(2R)-2-phenylbutanoic acid
InChI Key	OFJWFSNDPCAWDK-UHFFFAOYNA-N
Molecular Formula	C10H12O2

2,048

Trityl Tetrakis(pentafluorophenyl)borate, 97%

CAS: 136040-19-2 Molecular Formula: C43H15BF20 Molecular Weight (g/mol): 922.37 MDL Number: MFCD03426981 InChI Key: TZOSNOQHGGONMD-UHFFFAOYSA-N Synonym: triphenylmethylium tetrakis perfluorophenyl borate,trityl tetrakis pentafluorophenyl borate,trityl tetrapentafluorophenyl borate,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-,triphenylcarbenium tetrakis pentafluorophenyl borate,methylium, triphenyl-, tetrakis 2,3,4,5,6-pentafluorophenyl borate 1-1:1,tetrakis 2,3,4,5,6-pentafluorophenyl boranuide; triphenylmethylium,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-1:1,tritylium tetrakis pentafluorophenyl borate,triphenylmethyliumtetrakis pentafluorophenyl borate PubChem CID: 9832824 SMILES: C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=CC=C1.FC1=C(F)C(F)=C(C(F)=C1F)[B-](C1=C(F)C(F)=C(F)C(F)=C1F)(C1=C(F)C(F)=C(F)C(F)=C1F)C1=C(F)C(F)=C(F)C(F)=C1F

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Specifications

PubChem CID	9832824
CAS	136040-19-2
Molecular Weight (g/mol)	922.37
MDL Number	MFCD03426981
SMILES	C1=CC=C(C=C1)[C+](C1=CC=CC=C1)C1=CC=CC=C1.FC1=C(F)C(F)=C(C(F)=C1F)[B-](C1=C(F)C(F)=C(F)C(F)=C1F)(C1=C(F)C(F)=C(F)C(F)=C1F)C1=C(F)C(F)=C(F)C(F)=C1F
Synonym	triphenylmethylium tetrakis perfluorophenyl borate,trityl tetrakis pentafluorophenyl borate,trityl tetrapentafluorophenyl borate,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-,triphenylcarbenium tetrakis pentafluorophenyl borate,methylium, triphenyl-, tetrakis 2,3,4,5,6-pentafluorophenyl borate 1-1:1,tetrakis 2,3,4,5,6-pentafluorophenyl boranuide; triphenylmethylium,methylium, triphenyl-, tetrakis pentafluorophenyl borate 1-1:1,tritylium tetrakis pentafluorophenyl borate,triphenylmethyliumtetrakis pentafluorophenyl borate
InChI Key	TZOSNOQHGGONMD-UHFFFAOYSA-N
Molecular Formula	C43H15BF20

2,049

4-Nitro-2-(trifluoromethyl)benzoic acid, 97%

CAS: 320-37-6 Molecular Formula: C8H4F3NO4 Molecular Weight (g/mol): 235.12 MDL Number: MFCD04039246 InChI Key: BPCKZQCTLCTDST-UHFFFAOYSA-N Synonym: 4-nitro-2-trifluoromethyl benzoic acid,2-carboxy-5-nitrobenzotrifluoride,4-nitro-2-trifluoromethyl-benzoic acid,4-nitro-2-trifluoromethylbenzoic acid,benzoic acid, 4-nitro-2-trifluoromethyl,4-nitro-2-trifluoromethyl benzoic acid,pubchem1342,ksc496i1p,rarechem al bo 1444,2-trifluoromethyl-4-nitrobenzoic acid PubChem CID: 2782737 IUPAC Name: 4-nitro-2-(trifluoromethyl)benzoic acid SMILES: OC(=O)C1=C(C=C(C=C1)[N+]([O-])=O)C(F)(F)F

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Specifications

PubChem CID	2782737
CAS	320-37-6
Molecular Weight (g/mol)	235.12
MDL Number	MFCD04039246
SMILES	OC(=O)C1=C(C=C(C=C1)[N+]([O-])=O)C(F)(F)F
Synonym	4-nitro-2-trifluoromethyl benzoic acid,2-carboxy-5-nitrobenzotrifluoride,4-nitro-2-trifluoromethyl-benzoic acid,4-nitro-2-trifluoromethylbenzoic acid,benzoic acid, 4-nitro-2-trifluoromethyl,4-nitro-2-trifluoromethyl benzoic acid,pubchem1342,ksc496i1p,rarechem al bo 1444,2-trifluoromethyl-4-nitrobenzoic acid
IUPAC Name	4-nitro-2-(trifluoromethyl)benzoic acid
InChI Key	BPCKZQCTLCTDST-UHFFFAOYSA-N
Molecular Formula	C8H4F3NO4

2,050

2-Bromophenethyl alcohol, 99%

CAS: 1074-16-4 Molecular Formula: C₈H₉BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD00093566 InChI Key: ADLOWZRDUHSVRU-UHFFFAOYSA-N Synonym: 2-2-bromophenyl ethanol,2-bromophenethyl alcohol,2-bromophenethylalcohol,2-2-bromophenyl ethan-1-ol,benzeneethanol, 2-bromo,o-bromophenethyl alcohol,2-2-bromophenyl ethyl alcohol,2-bromobenzeneethanol,2-bromophenylethanol,pubchem16178 PubChem CID: 2734089 IUPAC Name: 2-(2-bromophenyl)ethanol SMILES: C1=CC=C(C(=C1)CCO)Br

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Specifications

PubChem CID	2734089
CAS	1074-16-4
Molecular Weight (g/mol)	201.06
MDL Number	MFCD00093566
SMILES	C1=CC=C(C(=C1)CCO)Br
Synonym	2-2-bromophenyl ethanol,2-bromophenethyl alcohol,2-bromophenethylalcohol,2-2-bromophenyl ethan-1-ol,benzeneethanol, 2-bromo,o-bromophenethyl alcohol,2-2-bromophenyl ethyl alcohol,2-bromobenzeneethanol,2-bromophenylethanol,pubchem16178
IUPAC Name	2-(2-bromophenyl)ethanol
InChI Key	ADLOWZRDUHSVRU-UHFFFAOYSA-N
Molecular Formula	C₈H₉BrO

2,051

Lumefantrine, 98%, Thermo Scientific Chemicals

CAS: 82186-77-4 Molecular Formula: C30H32Cl3NO Molecular Weight (g/mol): 528.94 MDL Number: MFCD05662268 InChI Key: DYLGFOYVTXJFJP-MYYYXRDXNA-N IUPAC Name: 2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl]ethan-1-ol SMILES: CCCCN(CCCC)CC(O)C1=CC(Cl)=CC2=C1C1=CC=C(Cl)C=C1\C2=C\C1=CC=C(Cl)C=C1

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Specifications

CAS	82186-77-4
Molecular Weight (g/mol)	528.94
MDL Number	MFCD05662268
SMILES	CCCCN(CCCC)CC(O)C1=CC(Cl)=CC2=C1C1=CC=C(Cl)C=C1\C2=C\C1=CC=C(Cl)C=C1
IUPAC Name	2-(dibutylamino)-1-[(9Z)-2,7-dichloro-9-[(4-chlorophenyl)methylidene]-9H-fluoren-4-yl]ethan-1-ol
InChI Key	DYLGFOYVTXJFJP-MYYYXRDXNA-N
Molecular Formula	C30H32Cl3NO

2,052

Benzyltrimethylammonium dichloroiodate, 99%

CAS: 114971-52-7 Molecular Formula: C₁₀H₁₆Cl₂IN Molecular Weight (g/mol): 348.04 MDL Number: MFCD00075259 InChI Key: PPDJNZTUDFPAHX-UHFFFAOYSA-N Synonym: benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate PubChem CID: 2724680 SMILES: C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl

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Specifications

PubChem CID	2724680
CAS	114971-52-7
Molecular Weight (g/mol)	348.04
MDL Number	MFCD00075259
SMILES	C[N+](C)(C)CC1=CC=CC=C1.Cl[I-]Cl
Synonym	benzyltrimethylammonium dichloroiodate,benzyltrimethylammonium dichloroiodide,btma-icl2,benzyl trimethylammonium dichloroiodate,benzyltrimethylazanium; dichloroiodanuide,pubchem21920,benzyltrimethylammoniumdichloroiodate
InChI Key	PPDJNZTUDFPAHX-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₆Cl₂IN

2,053

Thermo Scientific Chemicals 5-Sulfosalicylic acid dihydrate, 99+%

CAS: 5965-83-3 | C9H14O6S | 250.27 g/mol

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Specifications

Molecular Weight (g/mol)	250.27
CAS Min %	99.0
InChI Key	NFYHZVWMQHQKRU-UHFFFAOYSA-N
PubChem CID	2723734
Name Note	p.a.
Percent Purity	99+%
Fieser	01,1118
Infrared Spectrum	Authentic
Formula Weight	254.22
Melting Point	106.0°C to 110.0°C
CAS Max %	100.0
Color	White
Physical Form	Crystalline Powder
Chemical Name or Material	5-Sulfosalicylic acid dihydrate
SMILES	C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O
Merck Index	15, 9094
Assay Percent Range	99+%
CAS	97-05-2
Health Hazard 3	GHS P Statement IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Wear protective gloves/protective clothing/eye protection/face protection. IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,if pre
MDL Number	MFCD00007508,MFCD00149540
Health Hazard 2	GHS H Statement Causes severe skin burns and eye damage. Harmful if swallowed.
Solubility Information	Solubility in water: 127g/L (20°C). Other solubilities: soluble in alcohol and ether
Packaging	Plastic bottle
Health Hazard 1	GHS Signal Word: Danger
Synonym	2-hydroxy-5-sulfobenzoic acid dihydrate,5-sulfosalicylic acid dihydrate,sulfosalicylic acid dihydrate,benzoic acid, 2-hydroxy-5-sulfo-, dihydrate,unii-09ngq462s6,2-hydroxy-5-sulfobenzoic acid, hydrate, hydrate,5-sulfosalicylsyre,5-sulfosalicylsaeure,salicylic acid, 5-sulfo-, dihydrate,acmc-1aymd
Beilstein	11, 411
Molecular Formula	C9H14O6S

2,054

4-(tert-Butyl)benzylbromide, 97%

CAS: 18880-00-7 Molecular Formula: C₁₁H₁₅Br Molecular Weight (g/mol): 227.14 MDL Number: MFCD00000180 InChI Key: QZNQSIHCDAGZIA-UHFFFAOYSA-N Synonym: 4-tert-butylbenzyl bromide,p-tert-butylbenzyl bromide,1-bromomethyl-4-tert-butyl benzene,4-tert-butylbenzylbromide,1-bromomethyl-4-tert-butylbenzene,4-tert-butyl benzylbromide,p-t-butylbenzyl bromide,1-bromomethyl-4-1,1-dimethylethyl benzene,4-t-butylbenzylbromide,4-tert-buthylbenzyl bromide PubChem CID: 87836 IUPAC Name: 1-(bromomethyl)-4-tert-butylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)CBr

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Specifications

PubChem CID	87836
CAS	18880-00-7
Molecular Weight (g/mol)	227.14
MDL Number	MFCD00000180
SMILES	CC(C)(C)C1=CC=C(C=C1)CBr
Synonym	4-tert-butylbenzyl bromide,p-tert-butylbenzyl bromide,1-bromomethyl-4-tert-butyl benzene,4-tert-butylbenzylbromide,1-bromomethyl-4-tert-butylbenzene,4-tert-butyl benzylbromide,p-t-butylbenzyl bromide,1-bromomethyl-4-1,1-dimethylethyl benzene,4-t-butylbenzylbromide,4-tert-buthylbenzyl bromide
IUPAC Name	1-(bromomethyl)-4-tert-butylbenzene
InChI Key	QZNQSIHCDAGZIA-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₅Br

2,055

Thermo Scientific Chemicals N-alpha-FMOC-N-Trityl-L-histidine, 98%

CAS: 109425-51-6 Molecular Formula: C₄₀H₃₃N₃O₄ Molecular Weight (g/mol): 619.72 InChI Key: XXMYDXUIZKNHDT-QNGWXLTQSA-N Synonym: fmoc-his trt-oh,n-fmoc-n'-trityl-l-histidine,nalpha-fmoc-nim-trityl-l-histidine,n-a-fmoc-n-im-trityl-l-histidine,n,a-fmoc-n im-trityl-l-histidine,histidine, n-9h-fluoren-9-ylmethoxy carbonyl-1-triphenylmethyl,2s-2-9h-fluoren-9-ylmethoxycarbonylamino-3-1-tritylimidazol-4-yl propanoic acid,fmochis trt oh,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino-3-1-triphenylmethyl imidazol-4-yl propanoic acid,ambotzfaa1090 PubChem CID: 11422193 IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1-tritylimidazol-4-yl)propanoic acid SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)CC(C(=O)O)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57

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Specifications

PubChem CID	11422193
CAS	109425-51-6
Molecular Weight (g/mol)	619.72
SMILES	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)CC(C(=O)O)NC(=O)OCC5C6=CC=CC=C6C7=CC=CC=C57
Synonym	fmoc-his trt-oh,n-fmoc-n'-trityl-l-histidine,nalpha-fmoc-nim-trityl-l-histidine,n-a-fmoc-n-im-trityl-l-histidine,n,a-fmoc-n im-trityl-l-histidine,histidine, n-9h-fluoren-9-ylmethoxy carbonyl-1-triphenylmethyl,2s-2-9h-fluoren-9-ylmethoxycarbonylamino-3-1-tritylimidazol-4-yl propanoic acid,fmochis trt oh,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino-3-1-triphenylmethyl imidazol-4-yl propanoic acid,ambotzfaa1090
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1-tritylimidazol-4-yl)propanoic acid
InChI Key	XXMYDXUIZKNHDT-QNGWXLTQSA-N
Molecular Formula	C₄₀H₃₃N₃O₄

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