Benzenoids
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Homosulfamine Hydrochloride 98.0+%, TCI America™
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CAS: 138-37-4 Molecular Formula: C7H11ClN2O2S Molecular Weight (g/mol): 222.687 MDL Number: MFCD00013005 InChI Key: SIACJRVYIPXFKS-UHFFFAOYSA-N Synonym: alpha-Amino-p-toluenesulfonamide Hydrochloride, Mafenide Hydrochloride PubChem CID: 67313 IUPAC Name: 4-(aminomethyl)benzenesulfonamide;hydrochloride SMILES: C1=CC(=CC=C1CN)S(=O)(=O)N.Cl
| PubChem CID | 67313 |
|---|---|
| CAS | 138-37-4 |
| Molecular Weight (g/mol) | 222.687 |
| MDL Number | MFCD00013005 |
| SMILES | C1=CC(=CC=C1CN)S(=O)(=O)N.Cl |
| Synonym | alpha-Amino-p-toluenesulfonamide Hydrochloride, Mafenide Hydrochloride |
| IUPAC Name | 4-(aminomethyl)benzenesulfonamide;hydrochloride |
| InChI Key | SIACJRVYIPXFKS-UHFFFAOYSA-N |
| Molecular Formula | C7H11ClN2O2S |
4-Amino-3-bromobenzonitrile 98.0+%, TCI America™
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(R,R)-N-(2-Amino-1,2-diphenylethyl)-p-toluenesulfonamide 98.0+%, TCI America™
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CAS: 144222-34-4 Molecular Formula: C21H23N2O2S Molecular Weight (g/mol): 367.49 MDL Number: MFCD02093428 InChI Key: UOPFIWYXBIHPIP-NHCUHLMSSA-O Synonym: 1r,2r---n-4-toluenesulfonyl-1,2-diphenylethylenediamine,1r,2r---n-p-tosyl-1,2-diphenylethylenediamine,r,r-tsdpen,r,r-n-p-toluenesulfonyl-1,2-diphenylethylenediamine,1r,2r-n-p-tosyl-1,2-diphenylethylenediamine,n-1r,2r-2-amino-1,2-diphenylethyl-4-methylbenzenesulfonamide,r,r-n-2-amino-1,2-diphenylethyl-p-toluenesulfonamide,1r,2r---n-p-tosyl-1,2-diphenylethylene diamine,1r, 2r---n-4-toluene sulfonyl 1,2-diphenyl-1,2-ethane diamine,benzenesulfonamide, n-1r,2r-2-amino-1,2-diphenylethyl-4-methyl PubChem CID: 2734565 IUPAC Name: N-[(1R,2R)-2-azaniumyl-1,2-diphenylethyl]-4-methylbenzene-1-sulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@H]([NH3+])C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2734565 |
|---|---|
| CAS | 144222-34-4 |
| Molecular Weight (g/mol) | 367.49 |
| MDL Number | MFCD02093428 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]([C@H]([NH3+])C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1r,2r---n-4-toluenesulfonyl-1,2-diphenylethylenediamine,1r,2r---n-p-tosyl-1,2-diphenylethylenediamine,r,r-tsdpen,r,r-n-p-toluenesulfonyl-1,2-diphenylethylenediamine,1r,2r-n-p-tosyl-1,2-diphenylethylenediamine,n-1r,2r-2-amino-1,2-diphenylethyl-4-methylbenzenesulfonamide,r,r-n-2-amino-1,2-diphenylethyl-p-toluenesulfonamide,1r,2r---n-p-tosyl-1,2-diphenylethylene diamine,1r, 2r---n-4-toluene sulfonyl 1,2-diphenyl-1,2-ethane diamine,benzenesulfonamide, n-1r,2r-2-amino-1,2-diphenylethyl-4-methyl |
| IUPAC Name | N-[(1R,2R)-2-azaniumyl-1,2-diphenylethyl]-4-methylbenzene-1-sulfonamide |
| InChI Key | UOPFIWYXBIHPIP-NHCUHLMSSA-O |
| Molecular Formula | C21H23N2O2S |
1,5-Dimercaptonaphthalene 98.0+%, TCI America™
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CAS: 5325-88-2 Molecular Formula: C10H8S2 Molecular Weight (g/mol): 192.294 MDL Number: MFCD00068909 InChI Key: AAPAGLBSROJFGM-UHFFFAOYSA-N Synonym: 1,5-Naphthalenedithiol PubChem CID: 21397 IUPAC Name: naphthalene-1,5-dithiol SMILES: C1=CC2=C(C=CC=C2S)C(=C1)S
| PubChem CID | 21397 |
|---|---|
| CAS | 5325-88-2 |
| Molecular Weight (g/mol) | 192.294 |
| MDL Number | MFCD00068909 |
| SMILES | C1=CC2=C(C=CC=C2S)C(=C1)S |
| Synonym | 1,5-Naphthalenedithiol |
| IUPAC Name | naphthalene-1,5-dithiol |
| InChI Key | AAPAGLBSROJFGM-UHFFFAOYSA-N |
| Molecular Formula | C10H8S2 |
Tofisopam 98.0+%, TCI America™
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CAS: 22345-47-7 Molecular Formula: C22H26N2O4 Molecular Weight (g/mol): 382.46 MDL Number: MFCD00823171 InChI Key: RUJBDQSFYCKFAA-UHFFFAOYSA-N Synonym: 1-(3,4-Dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-benzo[d][1,2]diazepine, 1-(3,4-Dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine PubChem CID: 5502 IUPAC Name: 1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine SMILES: CCC1C(=NN=C(C2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC)C
| PubChem CID | 5502 |
|---|---|
| CAS | 22345-47-7 |
| Molecular Weight (g/mol) | 382.46 |
| MDL Number | MFCD00823171 |
| SMILES | CCC1C(=NN=C(C2=CC(=C(C=C12)OC)OC)C3=CC(=C(C=C3)OC)OC)C |
| Synonym | 1-(3,4-Dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-benzo[d][1,2]diazepine, 1-(3,4-Dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine |
| IUPAC Name | 1-(3,4-dimethoxyphenyl)-5-ethyl-7,8-dimethoxy-4-methyl-5H-2,3-benzodiazepine |
| InChI Key | RUJBDQSFYCKFAA-UHFFFAOYSA-N |
| Molecular Formula | C22H26N2O4 |
3-Fluoro-5-(trifluoromethyl)benzaldehyde 98.0+%, TCI America™
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CAS: 188815-30-7 Molecular Formula: C8H4F4O Molecular Weight (g/mol): 192.113 MDL Number: MFCD00061312 InChI Key: UZZYXZWSOWQPIS-UHFFFAOYSA-N Synonym: 3-fluoro-5-trifluoromethyl benzaldehyde,3-fluoro-5-formylbenzotrifluoride,alpha,alpha,alpha,5-tetrafluoro-m-tolualdehyde,benzaldehyde, 3-fluoro-5-trifluoromethyl,pubchem4239,acmc-1bzt1,5-tetrafluoro-m-tolualdehyde,3-fluoro-5-trifluromethylbenzaldehyde PubChem CID: 605686 IUPAC Name: 3-fluoro-5-(trifluoromethyl)benzaldehyde SMILES: C1=C(C=C(C=C1C(F)(F)F)F)C=O
| PubChem CID | 605686 |
|---|---|
| CAS | 188815-30-7 |
| Molecular Weight (g/mol) | 192.113 |
| MDL Number | MFCD00061312 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)F)C=O |
| Synonym | 3-fluoro-5-trifluoromethyl benzaldehyde,3-fluoro-5-formylbenzotrifluoride,alpha,alpha,alpha,5-tetrafluoro-m-tolualdehyde,benzaldehyde, 3-fluoro-5-trifluoromethyl,pubchem4239,acmc-1bzt1,5-tetrafluoro-m-tolualdehyde,3-fluoro-5-trifluromethylbenzaldehyde |
| IUPAC Name | 3-fluoro-5-(trifluoromethyl)benzaldehyde |
| InChI Key | UZZYXZWSOWQPIS-UHFFFAOYSA-N |
| Molecular Formula | C8H4F4O |
2-Methylbenzhydryl Chloride 98.0+%, TCI America™
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CAS: 41870-52-4 Molecular Formula: C14H13Cl Molecular Weight (g/mol): 216.71 MDL Number: MFCD00972765 InChI Key: VTZTUKIBJQCCMO-UHFFFAOYNA-N Synonym: 2-(alpha-Chlorobenzyl)toluene, Chloro(2-methylphenyl)phenylmethane PubChem CID: 10798787 IUPAC Name: 1-[chloro(phenyl)methyl]-2-methylbenzene SMILES: CC1=CC=CC=C1C(Cl)C1=CC=CC=C1
| PubChem CID | 10798787 |
|---|---|
| CAS | 41870-52-4 |
| Molecular Weight (g/mol) | 216.71 |
| MDL Number | MFCD00972765 |
| SMILES | CC1=CC=CC=C1C(Cl)C1=CC=CC=C1 |
| Synonym | 2-(alpha-Chlorobenzyl)toluene, Chloro(2-methylphenyl)phenylmethane |
| IUPAC Name | 1-[chloro(phenyl)methyl]-2-methylbenzene |
| InChI Key | VTZTUKIBJQCCMO-UHFFFAOYNA-N |
| Molecular Formula | C14H13Cl |
Methyl 2-Chloro-5-nitrobenzoate 98.0+%, TCI America™
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CAS: 6307-82-0 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.589 MDL Number: MFCD00184587 InChI Key: VCYWZLGOWNCJNJ-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzoic acid methyl ester,benzoic acid, 2-chloro-5-nitro-, methyl ester,methyl 2-chloro-5-nitrobenzenecarboxylate,2-chloro-5-nitro-benzoic acid methyl ester,methylester kyseliny 2-chlor-5-nitrobenzoove czech,pubchem3711,acmc-209ncv,methylester kyseliny 2-chlor-5-nitrobenzoove,4-09-00-01228 beilstein handbook reference,methyl2-chloro-5-nitrobenzoate PubChem CID: 22754 IUPAC Name: methyl 2-chloro-5-nitrobenzoate SMILES: COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl
| PubChem CID | 22754 |
|---|---|
| CAS | 6307-82-0 |
| Molecular Weight (g/mol) | 215.589 |
| MDL Number | MFCD00184587 |
| SMILES | COC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl |
| Synonym | 2-chloro-5-nitrobenzoic acid methyl ester,benzoic acid, 2-chloro-5-nitro-, methyl ester,methyl 2-chloro-5-nitrobenzenecarboxylate,2-chloro-5-nitro-benzoic acid methyl ester,methylester kyseliny 2-chlor-5-nitrobenzoove czech,pubchem3711,acmc-209ncv,methylester kyseliny 2-chlor-5-nitrobenzoove,4-09-00-01228 beilstein handbook reference,methyl2-chloro-5-nitrobenzoate |
| IUPAC Name | methyl 2-chloro-5-nitrobenzoate |
| InChI Key | VCYWZLGOWNCJNJ-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4 |
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl Acetate 96.0+%, TCI America™
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CAS: 480424-70-2 Molecular Formula: C14H19BO4 Molecular Weight (g/mol): 262.11 MDL Number: MFCD03453060 InChI Key: KHBAJCWEQNVCSN-UHFFFAOYSA-N Synonym: 4-Acetoxyphenylboronic Acid Pinacol Ester, 2-(4-Acetoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 2774004 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate SMILES: CC(=O)OC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1
| PubChem CID | 2774004 |
|---|---|
| CAS | 480424-70-2 |
| Molecular Weight (g/mol) | 262.11 |
| MDL Number | MFCD03453060 |
| SMILES | CC(=O)OC1=CC=C(C=C1)B1OC(C)(C)C(C)(C)O1 |
| Synonym | 4-Acetoxyphenylboronic Acid Pinacol Ester, 2-(4-Acetoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane |
| IUPAC Name | 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl acetate |
| InChI Key | KHBAJCWEQNVCSN-UHFFFAOYSA-N |
| Molecular Formula | C14H19BO4 |
4-(Trifluoromethyl)styrene (stabilized with TBC) 98.0+%, TCI America™
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CAS: 402-50-6 Molecular Formula: C9H7F3 Molecular Weight (g/mol): 172.15 MDL Number: MFCD00075539 InChI Key: CEWDRCQPGANDRS-UHFFFAOYSA-N Synonym: 1-trifluoromethyl-4-vinylbenzene,4-trifluoromethyl styrene,4-trifluoromethylstyrene,1-ethenyl-4-trifluoromethyl benzene,4-vinylbenzotrifluoride,1-trifluoromethyl-4-vinyl-benzene,4-trifluoromethystyrene,p-trifluoromethylstyrene,pubchem15485,acmc-1aivr PubChem CID: 2782798 IUPAC Name: 1-ethenyl-4-(trifluoromethyl)benzene SMILES: C=CC1=CC=C(C=C1)C(F)(F)F
| PubChem CID | 2782798 |
|---|---|
| CAS | 402-50-6 |
| Molecular Weight (g/mol) | 172.15 |
| MDL Number | MFCD00075539 |
| SMILES | C=CC1=CC=C(C=C1)C(F)(F)F |
| Synonym | 1-trifluoromethyl-4-vinylbenzene,4-trifluoromethyl styrene,4-trifluoromethylstyrene,1-ethenyl-4-trifluoromethyl benzene,4-vinylbenzotrifluoride,1-trifluoromethyl-4-vinyl-benzene,4-trifluoromethystyrene,p-trifluoromethylstyrene,pubchem15485,acmc-1aivr |
| IUPAC Name | 1-ethenyl-4-(trifluoromethyl)benzene |
| InChI Key | CEWDRCQPGANDRS-UHFFFAOYSA-N |
| Molecular Formula | C9H7F3 |
2,4,6-Trimethylphenol 98.0+%, TCI America™
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CAS: 527-60-6 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002235 InChI Key: BPRYUXCVCCNUFE-UHFFFAOYSA-N Synonym: mesitol,phenol, 2,4,6-trimethyl,mesityl alcohol,2-hydroxymesitylene,2,4,6-trimetylofenol,1,3,5-trimethylphenol,2,4,6-trimethyl-phenol,1-hydroxy-2,4,6-trimethylbenzene,2,4,6-trimethylofenol,unii-fpz32614n6 PubChem CID: 10698 IUPAC Name: 2,4,6-trimethylphenol SMILES: CC1=CC(=C(C(=C1)C)O)C
| PubChem CID | 10698 |
|---|---|
| CAS | 527-60-6 |
| Molecular Weight (g/mol) | 136.194 |
| MDL Number | MFCD00002235 |
| SMILES | CC1=CC(=C(C(=C1)C)O)C |
| Synonym | mesitol,phenol, 2,4,6-trimethyl,mesityl alcohol,2-hydroxymesitylene,2,4,6-trimetylofenol,1,3,5-trimethylphenol,2,4,6-trimethyl-phenol,1-hydroxy-2,4,6-trimethylbenzene,2,4,6-trimethylofenol,unii-fpz32614n6 |
| IUPAC Name | 2,4,6-trimethylphenol |
| InChI Key | BPRYUXCVCCNUFE-UHFFFAOYSA-N |
| Molecular Formula | C9H12O |
2-Amino-2',5-dichlorobenzophenone 98.0+%, TCI America™
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CAS: 2958-36-3 Molecular Formula: C13H9Cl2NO Molecular Weight (g/mol): 266.121 MDL Number: MFCD00007840 InChI Key: KWZYIAJRFJVQDO-UHFFFAOYSA-N Synonym: 2-amino-2',5-dichlorobenzophenone,2-amino-5-chlorophenyl 2-chlorophenyl methanone,4-chloro-2-2-chlorobenzoyl aniline,methanone, 2-amino-5-chlorophenyl 2-chlorophenyl,unii-g806veo3ke,2-amino-5-chloro-2'-chlorobenzophenone,2-amino-5-chlorophenyl-2-chlorophenyl methanone,g806veo3ke,benzophenone, 2-amino-2',5-dichloro,2-amino-5,2'-dichlorobenzophenone PubChem CID: 18069 IUPAC Name: (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)Cl
| PubChem CID | 18069 |
|---|---|
| CAS | 2958-36-3 |
| Molecular Weight (g/mol) | 266.121 |
| MDL Number | MFCD00007840 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)Cl |
| Synonym | 2-amino-2',5-dichlorobenzophenone,2-amino-5-chlorophenyl 2-chlorophenyl methanone,4-chloro-2-2-chlorobenzoyl aniline,methanone, 2-amino-5-chlorophenyl 2-chlorophenyl,unii-g806veo3ke,2-amino-5-chloro-2'-chlorobenzophenone,2-amino-5-chlorophenyl-2-chlorophenyl methanone,g806veo3ke,benzophenone, 2-amino-2',5-dichloro,2-amino-5,2'-dichlorobenzophenone |
| IUPAC Name | (2-amino-5-chlorophenyl)-(2-chlorophenyl)methanone |
| InChI Key | KWZYIAJRFJVQDO-UHFFFAOYSA-N |
| Molecular Formula | C13H9Cl2NO |
Phenyl Isonicotinate, TCI America™
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CAS: 94-00-8 Molecular Formula: C12H9NO2 Molecular Weight (g/mol): 199.209 MDL Number: MFCD00059787 InChI Key: RGQQGHGIUCRECH-UHFFFAOYSA-N Synonym: Isonicotinic Acid Phenyl Ester, Phenyl 4-Pyridinecarboxylate PubChem CID: 571548 IUPAC Name: phenyl pyridine-4-carboxylate SMILES: C1=CC=C(C=C1)OC(=O)C2=CC=NC=C2
| PubChem CID | 571548 |
|---|---|
| CAS | 94-00-8 |
| Molecular Weight (g/mol) | 199.209 |
| MDL Number | MFCD00059787 |
| SMILES | C1=CC=C(C=C1)OC(=O)C2=CC=NC=C2 |
| Synonym | Isonicotinic Acid Phenyl Ester, Phenyl 4-Pyridinecarboxylate |
| IUPAC Name | phenyl pyridine-4-carboxylate |
| InChI Key | RGQQGHGIUCRECH-UHFFFAOYSA-N |
| Molecular Formula | C12H9NO2 |
p-Terphenyl (purified by sublimation) 99.5+%, TCI America™
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CAS: 92-94-4 Molecular Formula: C18H14 Molecular Weight (g/mol): 230.31 MDL Number: MFCD00003061 InChI Key: XJKSTNDFUHDPQJ-UHFFFAOYSA-N Synonym: p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin PubChem CID: 7115 ChEBI: CHEBI:52242 IUPAC Name: 1,4-diphenylbenzene SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3
| PubChem CID | 7115 |
|---|---|
| CAS | 92-94-4 |
| Molecular Weight (g/mol) | 230.31 |
| ChEBI | CHEBI:52242 |
| MDL Number | MFCD00003061 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=CC=C3 |
| Synonym | p-terphenyl,1,1':4',1-terphenyl,p-diphenylbenzene,p-triphenyl,santowax p,4-phenylbiphenyl,4-phenyldiphenyl,para-terphenyl,biphenyl, 4-phenyl,pyrogallol tannin |
| IUPAC Name | 1,4-diphenylbenzene |
| InChI Key | XJKSTNDFUHDPQJ-UHFFFAOYSA-N |
| Molecular Formula | C18H14 |
4-Chloro-2-methylbenzyl Alcohol 98.0+%, TCI America™
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CAS: 129716-11-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD06201140 InChI Key: AHXBDGJNZJKLNE-UHFFFAOYSA-N Synonym: 4-chloro-2-methylphenyl methanol,4-chloro-2-methylbenzyl alcohol,benzenemethanol, 4-chloro-2-methyl,acmc-20aaxd,4-chloro-2-methylbenzylalcohol,4-chloro-2-methyl-phenyl-methanol PubChem CID: 2757669 IUPAC Name: (4-chloro-2-methylphenyl)methanol SMILES: CC1=C(C=CC(=C1)Cl)CO
| PubChem CID | 2757669 |
|---|---|
| CAS | 129716-11-6 |
| Molecular Weight (g/mol) | 156.609 |
| MDL Number | MFCD06201140 |
| SMILES | CC1=C(C=CC(=C1)Cl)CO |
| Synonym | 4-chloro-2-methylphenyl methanol,4-chloro-2-methylbenzyl alcohol,benzenemethanol, 4-chloro-2-methyl,acmc-20aaxd,4-chloro-2-methylbenzylalcohol,4-chloro-2-methyl-phenyl-methanol |
| IUPAC Name | (4-chloro-2-methylphenyl)methanol |
| InChI Key | AHXBDGJNZJKLNE-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |