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.

211 – 225 of 55,094 results

211

3-Methoxyphenyl isocyanate, 99%

CAS: 18908-07-1 Molecular Formula: C₈H₇NO₂ Molecular Weight (g/mol): 149.15 MDL Number: MFCD00002019 InChI Key: NPOVTGVGOBJZPY-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate PubChem CID: 87843 IUPAC Name: 1-isocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=O

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Specifications

PubChem CID	87843
CAS	18908-07-1
Molecular Weight (g/mol)	149.15
MDL Number	MFCD00002019
SMILES	COC1=CC=CC(=C1)N=C=O
Synonym	3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate
IUPAC Name	1-isocyanato-3-methoxybenzene
InChI Key	NPOVTGVGOBJZPY-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO₂

212

3-Iodoanisole, 97%

CAS: 766-85-8 Molecular Formula: C₇H₇IO Molecular Weight (g/mol): 234.04 MDL Number: MFCD00001048 InChI Key: RSHBAGGASAJQCH-UHFFFAOYSA-N Synonym: 3-iodoanisole,m-iodoanisole,benzene, 1-iodo-3-methoxy,anisole, m-iodo,m-methoxyiodobenzene,3-methoxyphenyl iodide,3-methoxyiodobenzene,1-iodo-3-methoxy-benzene,m-iodoanisol,m-iodo-anisole PubChem CID: 69839 IUPAC Name: 1-iodo-3-methoxybenzene SMILES: COC1=CC(=CC=C1)I

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Specifications

PubChem CID	69839
CAS	766-85-8
Molecular Weight (g/mol)	234.04
MDL Number	MFCD00001048
SMILES	COC1=CC(=CC=C1)I
Synonym	3-iodoanisole,m-iodoanisole,benzene, 1-iodo-3-methoxy,anisole, m-iodo,m-methoxyiodobenzene,3-methoxyphenyl iodide,3-methoxyiodobenzene,1-iodo-3-methoxy-benzene,m-iodoanisol,m-iodo-anisole
IUPAC Name	1-iodo-3-methoxybenzene
InChI Key	RSHBAGGASAJQCH-UHFFFAOYSA-N
Molecular Formula	C₇H₇IO

213

(R)-(-)-alpha-Methoxyphenylacetic acid, 99%

CAS: 3966-32-3 Molecular Formula: C₉H₁₀O₃ Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004250 InChI Key: DIWVBIXQCNRCFE-MRVPVSSYSA-N Synonym: r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j PubChem CID: 2724294 IUPAC Name: (2R)-2-methoxy-2-phenylacetic acid SMILES: COC(C1=CC=CC=C1)C(=O)O

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Specifications

PubChem CID	2724294
CAS	3966-32-3
Molecular Weight (g/mol)	166.18
MDL Number	MFCD00004250
SMILES	COC(C1=CC=CC=C1)C(=O)O
Synonym	r---alpha-methoxyphenylacetic acid,r-2-methoxy-2-phenylacetic acid,2r-2-methoxy-2-phenylacetic acid,r-methoxyphenylacetic acid,r-methoxy phenyl acetic acid,methoxy phenyl acetic acid #,r---.alpha.-methoxyphenylacetic acid,benzeneacetic acid, .alpha.-methoxy-, r,o-methyl-d-mandelic acid,ksc496q9j
IUPAC Name	(2R)-2-methoxy-2-phenylacetic acid
InChI Key	DIWVBIXQCNRCFE-MRVPVSSYSA-N
Molecular Formula	C₉H₁₀O₃

214

Tolylene 2,4-diisocyanate, 75%, technical

CAS: 584-84-9,91-08-7 Molecular Formula: C₉H₆N₂O₂ Molecular Weight (g/mol): 174.16 InChI Key: DVKJHBMWWAPEIU-UHFFFAOYSA-N Synonym: 2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate PubChem CID: 11443 ChEBI: CHEBI:53556 IUPAC Name: 2,4-diisocyanato-1-methylbenzene SMILES: CC1=C(C=C(C=C1)N=C=O)N=C=O

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Specifications

PubChem CID	11443
CAS	584-84-9,91-08-7
Molecular Weight (g/mol)	174.16
ChEBI	CHEBI:53556
SMILES	CC1=C(C=C(C=C1)N=C=O)N=C=O
Synonym	2,4-toluene diisocyanate,2,4-diisocyanatotoluene,tolylene-2,4-diisocyanate,toluene-2,4-diisocyanate,2,4-tolylene diisocyanate,toluene 2,4-diisocyanate,4-methyl-m-phenylene diisocyanate,tolylene diisocyanate,2,4-tdi,toluylene-2,4-diisocyanate
IUPAC Name	2,4-diisocyanato-1-methylbenzene
InChI Key	DVKJHBMWWAPEIU-UHFFFAOYSA-N
Molecular Formula	C₉H₆N₂O₂

215

Tetraphenylphosphonium chloride, 98%

CAS: 2001-45-8 Molecular Formula: C24H20ClP Molecular Weight (g/mol): 374.85 MDL Number: MFCD00011916 InChI Key: WAGFXJQAIZNSEQ-UHFFFAOYSA-M Synonym: tetraphenylphosphonium chloride,phosphonium, tetraphenyl-, chloride,tetraphenylphosphoniumchloride,tetraphenylchlorophosphine,tetraphenylphosphanium chloride,tetraphenyl phosphonium chloride,ph4pcl,tetraphenylphophonium chloride,tetraphenylphosphonium chloride, for the spectrophotometric det. of bi, co PubChem CID: 164911 IUPAC Name: tetraphenylphosphanium;chloride SMILES: [Cl-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	164911
CAS	2001-45-8
Molecular Weight (g/mol)	374.85
MDL Number	MFCD00011916
SMILES	[Cl-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	tetraphenylphosphonium chloride,phosphonium, tetraphenyl-, chloride,tetraphenylphosphoniumchloride,tetraphenylchlorophosphine,tetraphenylphosphanium chloride,tetraphenyl phosphonium chloride,ph4pcl,tetraphenylphophonium chloride,tetraphenylphosphonium chloride, for the spectrophotometric det. of bi, co
IUPAC Name	tetraphenylphosphanium;chloride
InChI Key	WAGFXJQAIZNSEQ-UHFFFAOYSA-M
Molecular Formula	C24H20ClP

216

2,6-Bis(trifluoromethyl)benzoic acid, 98%

CAS: 24821-22-5 Molecular Formula: C₉H₄F₆O₂ Molecular Weight (g/mol): 258.11 InChI Key: XZNLSDPNMNWCRE-UHFFFAOYSA-N Synonym: 2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962 PubChem CID: 90618 IUPAC Name: 2,6-bis(trifluoromethyl)benzoic acid SMILES: C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F

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Specifications

PubChem CID	90618
CAS	24821-22-5
Molecular Weight (g/mol)	258.11
SMILES	C1=CC(=C(C(=C1)C(F)(F)F)C(=O)O)C(F)(F)F
Synonym	2,6-bis trifluoromethyl benzoic acid,benzoic acid, 2,6-bis trifluoromethyl,2,6-bis-trifluoromethylbenzoic acid,2,6-di trifluoromethyl benzoic acid,2,6-bis-trifluoromethyl-benzoic acid,2,6-bis trifluoromethyl-benzoic acid,pubchem4988,acmc-1co7v,rarechem al bo 0513,timtec-bb sbb000962
IUPAC Name	2,6-bis(trifluoromethyl)benzoic acid
InChI Key	XZNLSDPNMNWCRE-UHFFFAOYSA-N
Molecular Formula	C₉H₄F₆O₂

217

Methyltriphenylphosphonium iodide, 97%

CAS: 2065-66-9 Molecular Formula: C19H18IP Molecular Weight (g/mol): 404.23 MDL Number: MFCD00066175 InChI Key: JNMIXMFEVJHFNY-UHFFFAOYSA-M Synonym: methyltriphenylphosphonium iodide,methyl triphenylphosphonium iodide,methyltriphenylphosphanium iodide,methyl triphenyl phosphonium iodide,phosphonium, methyltriphenyl-, iodide,methyl triphenylphosphoniumiodide,methyl triphenyl phosphanium iodide,triphenylmethyl phosphonium iodide,pubchem15730 PubChem CID: 638159 SMILES: [I-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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Specifications

PubChem CID	638159
CAS	2065-66-9
Molecular Weight (g/mol)	404.23
MDL Number	MFCD00066175
SMILES	[I-].C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	methyltriphenylphosphonium iodide,methyl triphenylphosphonium iodide,methyltriphenylphosphanium iodide,methyl triphenyl phosphonium iodide,phosphonium, methyltriphenyl-, iodide,methyl triphenylphosphoniumiodide,methyl triphenyl phosphanium iodide,triphenylmethyl phosphonium iodide,pubchem15730
InChI Key	JNMIXMFEVJHFNY-UHFFFAOYSA-M
Molecular Formula	C19H18IP

218

3,4-Dihydroxybenzylamine hydrobromide, 98%

CAS: 16290-26-9 Molecular Formula: C7H10BrNO2 Molecular Weight (g/mol): 220.07 MDL Number: MFCD00012859 InChI Key: BVFZTXFCZAXSHN-UHFFFAOYSA-N Synonym: 3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide PubChem CID: 13343562 IUPAC Name: 4-(aminomethyl)benzene-1,2-diol;hydrobromide SMILES: [H+].[Br-].NCC1=CC=C(O)C(O)=C1

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Specifications

PubChem CID	13343562
CAS	16290-26-9
Molecular Weight (g/mol)	220.07
MDL Number	MFCD00012859
SMILES	[H+].[Br-].NCC1=CC=C(O)C(O)=C1
Synonym	3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide
IUPAC Name	4-(aminomethyl)benzene-1,2-diol;hydrobromide
InChI Key	BVFZTXFCZAXSHN-UHFFFAOYSA-N
Molecular Formula	C7H10BrNO2

219

9-Anthracenemethanol, 98%

CAS: 1468-95-7 Molecular Formula: C₁₅H₁₂O Molecular Weight (g/mol): 208.26 MDL Number: MFCD00001264 InChI Key: JCJNNHDZTLRSGN-UHFFFAOYSA-N Synonym: 9-anthracenemethanol,9-hydroxymethylanthracene,9-anthrylcarbinol,9-methylolanthracene,9-anthrylmethanol,9-hydroxymethylantracene,9-anthracene methanol,9-hydroxymethyl anthracene,anthracene-9-carbinol,ccris 7297 PubChem CID: 73848 IUPAC Name: anthracen-9-ylmethanol SMILES: C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CO

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Specifications

PubChem CID	73848
CAS	1468-95-7
Molecular Weight (g/mol)	208.26
MDL Number	MFCD00001264
SMILES	C1=CC=C2C(=C1)C=C3C=CC=CC3=C2CO
Synonym	9-anthracenemethanol,9-hydroxymethylanthracene,9-anthrylcarbinol,9-methylolanthracene,9-anthrylmethanol,9-hydroxymethylantracene,9-anthracene methanol,9-hydroxymethyl anthracene,anthracene-9-carbinol,ccris 7297
IUPAC Name	anthracen-9-ylmethanol
InChI Key	JCJNNHDZTLRSGN-UHFFFAOYSA-N
Molecular Formula	C₁₅H₁₂O

220

2-Methyl-3-nitrobenzyl chloride, 97%, Thermo Scientific™

CAS: 60468-54-4 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.61 MDL Number: MFCD00007165 InChI Key: XZNDXQGZPOZITR-UHFFFAOYSA-N Synonym: 2-methyl-3-nitrobenzyl chloride,1-chloromethyl-2-methyl-3-nitrobenzene,alpha-chloro-2-methyl-3-nitrotoluene,1-chloromethyl-2-methyl-3-nitro-benzene,2-methyl-3-nitrobenzylchloride,benzene, 1-chloromethyl-2-methyl-3-nitro,acmc-1b2j5,ksc497o8t,2-chloromethyl-6-nitrotoluene PubChem CID: 108947 IUPAC Name: 1-(chloromethyl)-2-methyl-3-nitrobenzene SMILES: CC1=C(CCl)C=CC=C1[N+]([O-])=O

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Specifications

PubChem CID	108947
CAS	60468-54-4
Molecular Weight (g/mol)	185.61
MDL Number	MFCD00007165
SMILES	CC1=C(CCl)C=CC=C1[N+]([O-])=O
Synonym	2-methyl-3-nitrobenzyl chloride,1-chloromethyl-2-methyl-3-nitrobenzene,alpha-chloro-2-methyl-3-nitrotoluene,1-chloromethyl-2-methyl-3-nitro-benzene,2-methyl-3-nitrobenzylchloride,benzene, 1-chloromethyl-2-methyl-3-nitro,acmc-1b2j5,ksc497o8t,2-chloromethyl-6-nitrotoluene
IUPAC Name	1-(chloromethyl)-2-methyl-3-nitrobenzene
InChI Key	XZNDXQGZPOZITR-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO2

221

Thermo Scientific Chemicals Xylometazoline hydrochloride, 99%

CAS: 1218-35-5 Molecular Formula: C₁₆H₂₄N₂·HCL Molecular Weight (g/mol): 280.84 InChI Key: YGWFCQYETHJKNX-UHFFFAOYSA-N Synonym: xylometazoline hydrochloride,xylometazoline hcl,2-4-tert-butyl-2,6-dimethylbenzyl-2-imidazoline hydrochloride,unii-x5s84033nz,dsstox_cid_25223,dsstox_rid_80760,dsstox_gsid_45223,2-4-tert-butyl-2,6-dimethyl-phenyl methyl-4,5-dihydro-1h-imidazole hydrochloride,2-4-tert-butyl-2,6-dimethylphenyl methyl-4,5-dihydro-1h-imidazole hydrochloride PubChem CID: 5282386 IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride SMILES: CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl

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Specifications

PubChem CID	5282386
CAS	1218-35-5
Molecular Weight (g/mol)	280.84
SMILES	CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.Cl
Synonym	xylometazoline hydrochloride,xylometazoline hcl,2-4-tert-butyl-2,6-dimethylbenzyl-2-imidazoline hydrochloride,unii-x5s84033nz,dsstox_cid_25223,dsstox_rid_80760,dsstox_gsid_45223,2-4-tert-butyl-2,6-dimethyl-phenyl methyl-4,5-dihydro-1h-imidazole hydrochloride,2-4-tert-butyl-2,6-dimethylphenyl methyl-4,5-dihydro-1h-imidazole hydrochloride
IUPAC Name	2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole;hydrochloride
InChI Key	YGWFCQYETHJKNX-UHFFFAOYSA-N
Molecular Formula	C₁₆H₂₄N₂·HCL

222

3-Chloro-4-hydroxyacetanilide, 98%

CAS: 3964-54-3 Molecular Formula: C8H8ClNO2 Molecular Weight (g/mol): 185.61 MDL Number: MFCD01318123 InChI Key: JULKJDRBSRRBHT-UHFFFAOYSA-N Synonym: n-3-chloro-4-hydroxyphenyl acetamide,3-chloro-4-hydroxyacetanilide,4-acetylamino-2-chlorophenol,2-chloro-4-acetamidophenol,acetamide, n-3-chloro-4-hydroxyphenyl,3'-chloro-4'-hydroxyacetanilide,zlchem 1169,paracetamol impurity c,chloro-4-acetamidophenol,3-chloro-4-hydroxyacet anilide PubChem CID: 77579 IUPAC Name: N-(3-chloro-4-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=C(O)C(Cl)=C1

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Specifications

PubChem CID	77579
CAS	3964-54-3
Molecular Weight (g/mol)	185.61
MDL Number	MFCD01318123
SMILES	CC(=O)NC1=CC=C(O)C(Cl)=C1
Synonym	n-3-chloro-4-hydroxyphenyl acetamide,3-chloro-4-hydroxyacetanilide,4-acetylamino-2-chlorophenol,2-chloro-4-acetamidophenol,acetamide, n-3-chloro-4-hydroxyphenyl,3'-chloro-4'-hydroxyacetanilide,zlchem 1169,paracetamol impurity c,chloro-4-acetamidophenol,3-chloro-4-hydroxyacet anilide
IUPAC Name	N-(3-chloro-4-hydroxyphenyl)acetamide
InChI Key	JULKJDRBSRRBHT-UHFFFAOYSA-N
Molecular Formula	C8H8ClNO2

223

Bifonazole, 98%, Thermo Scientific™

CAS: 60628-96-8 Molecular Formula: C₂₂H₁₈N₂ Molecular Weight (g/mol): 310.39 InChI Key: OCAPBUJLXMYKEJ-UHFFFAOYSA-N Synonym: bifonazole,mycospor,trifonazole,bifonazol,bifonazolum,amycor,azolmen,bifonazol inn-spanish,bifonazolum inn-latin,1-4-biphenylyl phenylmethyl-1h-imidazole PubChem CID: 2378 ChEBI: CHEBI:78692 IUPAC Name: 1-[phenyl-(4-phenylphenyl)methyl]imidazole SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)N4C=CN=C4

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Specifications

PubChem CID	2378
CAS	60628-96-8
Molecular Weight (g/mol)	310.39
ChEBI	CHEBI:78692
SMILES	C1=CC=C(C=C1)C2=CC=C(C=C2)C(C3=CC=CC=C3)N4C=CN=C4
Synonym	bifonazole,mycospor,trifonazole,bifonazol,bifonazolum,amycor,azolmen,bifonazol inn-spanish,bifonazolum inn-latin,1-4-biphenylyl phenylmethyl-1h-imidazole
IUPAC Name	1-[phenyl-(4-phenylphenyl)methyl]imidazole
InChI Key	OCAPBUJLXMYKEJ-UHFFFAOYSA-N
Molecular Formula	C₂₂H₁₈N₂

224

2-Fluorophenethyl bromide, 97%

CAS: 91319-54-9 Molecular Formula: C₈H₈BrF Molecular Weight (g/mol): 203.05 InChI Key: FQGDFWIQBCQXPS-UHFFFAOYSA-N Synonym: 2-fluorophenethyl bromide,1-2-bromoethyl-2-fluorobenzene,1-2-bromo-ethyl-2-fluoro-benzene,benzene, 1-2-bromoethyl-2-fluoro,2-2-bromoethyl-1-fluorobenzene,1-2-bromoethyl-2-fluoro-benzene,2-fluorophenyl-ethylbromide,acmc-209wk4,2-fluorophenyl ethyl bromide,2-2-fluorophenyl-ethylbromide PubChem CID: 2756964 IUPAC Name: 1-(2-bromoethyl)-2-fluorobenzene SMILES: C1=CC=C(C(=C1)CCBr)F

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Specifications

PubChem CID	2756964
CAS	91319-54-9
Molecular Weight (g/mol)	203.05
SMILES	C1=CC=C(C(=C1)CCBr)F
Synonym	2-fluorophenethyl bromide,1-2-bromoethyl-2-fluorobenzene,1-2-bromo-ethyl-2-fluoro-benzene,benzene, 1-2-bromoethyl-2-fluoro,2-2-bromoethyl-1-fluorobenzene,1-2-bromoethyl-2-fluoro-benzene,2-fluorophenyl-ethylbromide,acmc-209wk4,2-fluorophenyl ethyl bromide,2-2-fluorophenyl-ethylbromide
IUPAC Name	1-(2-bromoethyl)-2-fluorobenzene
InChI Key	FQGDFWIQBCQXPS-UHFFFAOYSA-N
Molecular Formula	C₈H₈BrF

225

3,5-Di-tert-butylsalicylic acid, 99%

CAS: 19715-19-6 Molecular Formula: C₁₅H₂₂O₃ Molecular Weight (g/mol): 250.34 MDL Number: MFCD00059058 InChI Key: ZWQBZEFLFSFEOS-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-2-hydroxybenzoic acid,3,5-bis-tert-butylsalicylic acid,3,5-di-tert-butylsalicylic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl hydroxy,benzoic acid, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-ditertbutyl salicylic acid,dibutylsalicylicacid,acmc-1c7qv,3,2-bis 1,1-dimethylethyl-2-hydroxybenzoic acid,ksc466o9n PubChem CID: 88208 IUPAC Name: 3,5-ditert-butyl-2-hydroxybenzoic acid SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C

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Specifications

PubChem CID	88208
CAS	19715-19-6
Molecular Weight (g/mol)	250.34
MDL Number	MFCD00059058
SMILES	CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)O)C(C)(C)C
Synonym	3,5-di-tert-butyl-2-hydroxybenzoic acid,3,5-bis-tert-butylsalicylic acid,3,5-di-tert-butylsalicylic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl hydroxy,benzoic acid, 3,5-bis 1,1-dimethylethyl-2-hydroxy,3,5-ditertbutyl salicylic acid,dibutylsalicylicacid,acmc-1c7qv,3,2-bis 1,1-dimethylethyl-2-hydroxybenzoic acid,ksc466o9n
IUPAC Name	3,5-ditert-butyl-2-hydroxybenzoic acid
InChI Key	ZWQBZEFLFSFEOS-UHFFFAOYSA-N
Molecular Formula	C₁₅H₂₂O₃

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