Benzene and substituted derivatives
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4-Methylstyrene, 98%, stab. with 0.1% 3,5-di-tert-butylcatechol
CAS: 622-97-9 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.18 MDL Number: MFCD00008621 InChI Key: JLBJTVDPSNHSKJ-UHFFFAOYSA-N Synonym: 4-methylstyrene,1-methyl-4-vinylbenzene,p-methylstyrene,4-vinyltoluene,p-vinyltoluene,benzene, 1-ethenyl-4-methyl,styrene, p-methyl,p-methyl styrene,1-p-tolylethene,para-methylstyrene PubChem CID: 12161 IUPAC Name: 1-ethenyl-4-methylbenzene SMILES: CC1=CC=C(C=C)C=C1
| PubChem CID | 12161 |
|---|---|
| CAS | 622-97-9 |
| Molecular Weight (g/mol) | 118.18 |
| MDL Number | MFCD00008621 |
| SMILES | CC1=CC=C(C=C)C=C1 |
| Synonym | 4-methylstyrene,1-methyl-4-vinylbenzene,p-methylstyrene,4-vinyltoluene,p-vinyltoluene,benzene, 1-ethenyl-4-methyl,styrene, p-methyl,p-methyl styrene,1-p-tolylethene,para-methylstyrene |
| IUPAC Name | 1-ethenyl-4-methylbenzene |
| InChI Key | JLBJTVDPSNHSKJ-UHFFFAOYSA-N |
| Molecular Formula | C9H10 |
4-Chloro-2-fluoro-5-nitrotoluene, 98%
CAS: 18349-11-6 Molecular Formula: C7H5ClFNO2 Molecular Weight (g/mol): 189.57 MDL Number: MFCD00134231 InChI Key: SJDPAVRCQNFVDM-UHFFFAOYSA-N Synonym: 4-chloro-2-fluoro-5-nitrotoluene,1-chloro-5-fluoro-4-methyl-2-nitro-benzene,toluene, 4-chloro-2-fluoro-5-nitro,benzene,1-chloro-5-fluoro-4-methyl-2-nitro,benzene, 1-chloro-5-fluoro-4-methyl-2-nitro,acmc-1c7av,4-chloro-2-fluoro-5-nitro-toluene,buttpark 146\15-31,2-chloro-4-floro-5-methylnitrobenzene,2-chloro-4-fluoro-5-methylnitrobenzene PubChem CID: 87593 IUPAC Name: 1-chloro-5-fluoro-4-methyl-2-nitrobenzene SMILES: CC1=CC(=C(Cl)C=C1F)[N+]([O-])=O
| PubChem CID | 87593 |
|---|---|
| CAS | 18349-11-6 |
| Molecular Weight (g/mol) | 189.57 |
| MDL Number | MFCD00134231 |
| SMILES | CC1=CC(=C(Cl)C=C1F)[N+]([O-])=O |
| Synonym | 4-chloro-2-fluoro-5-nitrotoluene,1-chloro-5-fluoro-4-methyl-2-nitro-benzene,toluene, 4-chloro-2-fluoro-5-nitro,benzene,1-chloro-5-fluoro-4-methyl-2-nitro,benzene, 1-chloro-5-fluoro-4-methyl-2-nitro,acmc-1c7av,4-chloro-2-fluoro-5-nitro-toluene,buttpark 146\15-31,2-chloro-4-floro-5-methylnitrobenzene,2-chloro-4-fluoro-5-methylnitrobenzene |
| IUPAC Name | 1-chloro-5-fluoro-4-methyl-2-nitrobenzene |
| InChI Key | SJDPAVRCQNFVDM-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClFNO2 |
2-Fluorotoluene, 99+%
CAS: 95-52-3 Molecular Formula: C7H7F Molecular Weight (g/mol): 110.131 MDL Number: MFCD00000322 InChI Key: MMZYCBHLNZVROM-UHFFFAOYSA-N Synonym: 2-fluorotoluene,o-fluorotoluene,benzene, 1-fluoro-2-methyl,toluene, o-fluoro,1-methyl-2-fluorobenzene,unii-l55xkb3k7h,1-fluoro-2-methyl-benzene,ortho-fluorotoluene,fluorotoluene,l55xkb3k7h PubChem CID: 7241 IUPAC Name: 1-fluoro-2-methylbenzene SMILES: CC1=CC=CC=C1F
| PubChem CID | 7241 |
|---|---|
| CAS | 95-52-3 |
| Molecular Weight (g/mol) | 110.131 |
| MDL Number | MFCD00000322 |
| SMILES | CC1=CC=CC=C1F |
| Synonym | 2-fluorotoluene,o-fluorotoluene,benzene, 1-fluoro-2-methyl,toluene, o-fluoro,1-methyl-2-fluorobenzene,unii-l55xkb3k7h,1-fluoro-2-methyl-benzene,ortho-fluorotoluene,fluorotoluene,l55xkb3k7h |
| IUPAC Name | 1-fluoro-2-methylbenzene |
| InChI Key | MMZYCBHLNZVROM-UHFFFAOYSA-N |
| Molecular Formula | C7H7F |
1,2-Bis(diphenylphosphino)benzene, 98%
CAS: 13991-08-7 Molecular Formula: C30H24P2 Molecular Weight (g/mol): 446.47 MDL Number: MFCD00014081 InChI Key: NFRYVRNCDXULEX-UHFFFAOYSA-N Synonym: 1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene PubChem CID: 498379 IUPAC Name: (2-diphenylphosphanylphenyl)-diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 498379 |
|---|---|
| CAS | 13991-08-7 |
| Molecular Weight (g/mol) | 446.47 |
| MDL Number | MFCD00014081 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 1,2-bis diphenylphosphino benzene,dppbz,dppbe,dppben,dppbenz,o-bis diphenylphosphino benzene,1,2-bis dimethylphosphino benzene,o-phenylenebis diphenylphosphine,phosphine, phenylenebis diphenyl,1,2-bis diphenylphosphanyl benzene |
| IUPAC Name | (2-diphenylphosphanylphenyl)-diphenylphosphane |
| InChI Key | NFRYVRNCDXULEX-UHFFFAOYSA-N |
| Molecular Formula | C30H24P2 |
4-Fluorophenylacetyl chloride, 98%
CAS: 459-04-1 Molecular Formula: C8H6ClFO Molecular Weight (g/mol): 172.58 MDL Number: MFCD00674181 InChI Key: SIOJFYRPBYGHOO-UHFFFAOYSA-N Synonym: 4-fluorophenylacetyl chloride,2-4-fluorophenyl acetyl chloride,4-fluorophenylacetylchloride,4-fluorobenzeneacetyl chloride,p-fluorophenylacetyl chloride,benzeneacetyl chloride, 4-fluoro,2-4-fluorophenyl ethanoyl chloride,4-fluoro phenylacetyl chloride,pubchem17517,acmc-1aivq PubChem CID: 3744988 IUPAC Name: 2-(4-fluorophenyl)acetyl chloride SMILES: FC1=CC=C(CC(Cl)=O)C=C1
| PubChem CID | 3744988 |
|---|---|
| CAS | 459-04-1 |
| Molecular Weight (g/mol) | 172.58 |
| MDL Number | MFCD00674181 |
| SMILES | FC1=CC=C(CC(Cl)=O)C=C1 |
| Synonym | 4-fluorophenylacetyl chloride,2-4-fluorophenyl acetyl chloride,4-fluorophenylacetylchloride,4-fluorobenzeneacetyl chloride,p-fluorophenylacetyl chloride,benzeneacetyl chloride, 4-fluoro,2-4-fluorophenyl ethanoyl chloride,4-fluoro phenylacetyl chloride,pubchem17517,acmc-1aivq |
| IUPAC Name | 2-(4-fluorophenyl)acetyl chloride |
| InChI Key | SIOJFYRPBYGHOO-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClFO |
Methyl 4-bromo-3-methylbenzoate, 95%
CAS: 148547-19-7 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 InChI Key: GTZTYNPAPQKIIR-UHFFFAOYSA-N Synonym: 4-bromo-3-methylbenzoic acid methyl ester,methyl4-bromo-3-methylbenzoate,methyl 4-bromo-m-toluate,4-bromo-3-methyl-benzoic acid methyl ester,methyl 4-bromo-3-methyl-benzoate,4-bromo-m-toluic acid methyl ester,benzoic acid, 4-bromo-3-methyl-, methyl ester,2-bromo-5-methoxycarbonyl toluene,3-methyl-4-bromobenzoic acid methyl ester,pubchem3970 PubChem CID: 3294148 IUPAC Name: methyl 4-bromo-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)Br
| PubChem CID | 3294148 |
|---|---|
| CAS | 148547-19-7 |
| Molecular Weight (g/mol) | 229.07 |
| SMILES | CC1=C(C=CC(=C1)C(=O)OC)Br |
| Synonym | 4-bromo-3-methylbenzoic acid methyl ester,methyl4-bromo-3-methylbenzoate,methyl 4-bromo-m-toluate,4-bromo-3-methyl-benzoic acid methyl ester,methyl 4-bromo-3-methyl-benzoate,4-bromo-m-toluic acid methyl ester,benzoic acid, 4-bromo-3-methyl-, methyl ester,2-bromo-5-methoxycarbonyl toluene,3-methyl-4-bromobenzoic acid methyl ester,pubchem3970 |
| IUPAC Name | methyl 4-bromo-3-methylbenzoate |
| InChI Key | GTZTYNPAPQKIIR-UHFFFAOYSA-N |
| Molecular Formula | C9H9BrO2 |
4-tert-Butylbenzeneboronic acid, 97%
CAS: 123324-71-0 Molecular Formula: C10H15BO2 Molecular Weight (g/mol): 178.04 MDL Number: MFCD01009697 InChI Key: MNJYZNVROSZZQC-UHFFFAOYSA-N Synonym: 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid PubChem CID: 2734320 IUPAC Name: (4-tert-butylphenyl)boronic acid SMILES: CC(C)(C)C1=CC=C(C=C1)B(O)O
| PubChem CID | 2734320 |
|---|---|
| CAS | 123324-71-0 |
| Molecular Weight (g/mol) | 178.04 |
| MDL Number | MFCD01009697 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)B(O)O |
| Synonym | 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid |
| IUPAC Name | (4-tert-butylphenyl)boronic acid |
| InChI Key | MNJYZNVROSZZQC-UHFFFAOYSA-N |
| Molecular Formula | C10H15BO2 |
3-Aminosalicylic acid, 97%
CAS: 570-23-0 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00010299 InChI Key: IQGMRVWUTCYCST-UHFFFAOYSA-N Synonym: 3-aminosalicylic acid,3-amino salicylic acid,benzoic acid, 3-amino-2-hydroxy,3-amino-2-hydroxy-benzoic acid,2-amino-6-carboxyphenol,salicylic acid, 3-amino,3-carboxy-2-hydroxyaniline,3 or 5-aminosalicylic acid,benzoic acid, amino-2-hydroxy PubChem CID: 68443 IUPAC Name: 3-amino-2-hydroxybenzoic acid SMILES: C1=CC(=C(C(=C1)N)O)C(=O)O
| PubChem CID | 68443 |
|---|---|
| CAS | 570-23-0 |
| Molecular Weight (g/mol) | 153.14 |
| MDL Number | MFCD00010299 |
| SMILES | C1=CC(=C(C(=C1)N)O)C(=O)O |
| Synonym | 3-aminosalicylic acid,3-amino salicylic acid,benzoic acid, 3-amino-2-hydroxy,3-amino-2-hydroxy-benzoic acid,2-amino-6-carboxyphenol,salicylic acid, 3-amino,3-carboxy-2-hydroxyaniline,3 or 5-aminosalicylic acid,benzoic acid, amino-2-hydroxy |
| IUPAC Name | 3-amino-2-hydroxybenzoic acid |
| InChI Key | IQGMRVWUTCYCST-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
4,5-Bis(diphenylphosphino)-9,9-dimethylxanthene, 97%
CAS: 161265-03-8 Molecular Formula: C39H32OP2 Molecular Weight (g/mol): 578.63 MDL Number: MFCD00233866 InChI Key: CXNIUSPIQKWYAI-UHFFFAOYSA-N Synonym: xantphos,4,5-bis diphenylphosphino-9,9-dimethylxanthene,9,9-dimethyl-4,5-bis diphenylphosphino xanthene,9,9-dimethyl-9h-xanthene-4,5-diyl bis diphenylphosphine,dimethylbisdiphenylphosphinoxanthene,unii-nmu72mog9b,nmu72mog9b,9,9-dimethyl-9h-xanthene-4,5-diyl bis diphenylphosphane,5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl-diphenylphosphane,4,5-bis-diphenylphosphanyl-9,9-dimethyl-9h-xanthene PubChem CID: 636044 IUPAC Name: (5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane SMILES: CC1(C)C2=C(OC3=C1C=CC=C3P(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 636044 |
|---|---|
| CAS | 161265-03-8 |
| Molecular Weight (g/mol) | 578.63 |
| MDL Number | MFCD00233866 |
| SMILES | CC1(C)C2=C(OC3=C1C=CC=C3P(C1=CC=CC=C1)C1=CC=CC=C1)C(=CC=C2)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | xantphos,4,5-bis diphenylphosphino-9,9-dimethylxanthene,9,9-dimethyl-4,5-bis diphenylphosphino xanthene,9,9-dimethyl-9h-xanthene-4,5-diyl bis diphenylphosphine,dimethylbisdiphenylphosphinoxanthene,unii-nmu72mog9b,nmu72mog9b,9,9-dimethyl-9h-xanthene-4,5-diyl bis diphenylphosphane,5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl-diphenylphosphane,4,5-bis-diphenylphosphanyl-9,9-dimethyl-9h-xanthene |
| IUPAC Name | (5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane |
| InChI Key | CXNIUSPIQKWYAI-UHFFFAOYSA-N |
| Molecular Formula | C39H32OP2 |
2-Bromo-4-methylbenzaldehyde, 95%
CAS: 824-54-4 Molecular Formula: C8H7BrO Molecular Weight (g/mol): 199.05 MDL Number: MFCD04039890 InChI Key: MUZMDYCVUCMIDC-UHFFFAOYSA-N Synonym: benzaldehyde, 2-bromo-4-methyl,acmc-209pp2,ksc497q8b,tpc-i119,2-2-methoxyphenyl-2-methylamino cyclohexanone,2-bromo-4-methylbenzaldehyde, technical grade PubChem CID: 4645292 IUPAC Name: 2-bromo-4-methylbenzaldehyde SMILES: CC1=CC=C(C=O)C(Br)=C1
| PubChem CID | 4645292 |
|---|---|
| CAS | 824-54-4 |
| Molecular Weight (g/mol) | 199.05 |
| MDL Number | MFCD04039890 |
| SMILES | CC1=CC=C(C=O)C(Br)=C1 |
| Synonym | benzaldehyde, 2-bromo-4-methyl,acmc-209pp2,ksc497q8b,tpc-i119,2-2-methoxyphenyl-2-methylamino cyclohexanone,2-bromo-4-methylbenzaldehyde, technical grade |
| IUPAC Name | 2-bromo-4-methylbenzaldehyde |
| InChI Key | MUZMDYCVUCMIDC-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO |
2-(Bromomethyl)benzeneboronic acid, 97%
CAS: 91983-14-1 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318941 InChI Key: MYVJCOQGXCONPE-UHFFFAOYSA-N Synonym: 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781 PubChem CID: 2773278 IUPAC Name: [2-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=CC=C1CBr
| PubChem CID | 2773278 |
|---|---|
| CAS | 91983-14-1 |
| Molecular Weight (g/mol) | 214.85 |
| MDL Number | MFCD01318941 |
| SMILES | OB(O)C1=CC=CC=C1CBr |
| Synonym | 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781 |
| IUPAC Name | [2-(bromomethyl)phenyl]boronic acid |
| InChI Key | MYVJCOQGXCONPE-UHFFFAOYSA-N |
| Molecular Formula | C7H8BBrO2 |
2,6-Difluorobenzyl bromide, 96%
CAS: 85118-00-9 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.02 MDL Number: MFCD00000329 InChI Key: LSXJPJGBWSZHTM-UHFFFAOYSA-N Synonym: 2,6-difluorobenzyl bromide,2-bromomethyl-1,3-difluorobenzene,2,6-difluorobenzylbromide,alpha-bromo-2,6-difluorotoluene,benzene, 2-bromomethyl-1,3-difluoro,timtec-bb sbb006564,2-bromomethyl-1,3-difluoro-benzene,fr cf b1e,pubchem4915,acmc-209q4j PubChem CID: 581435 IUPAC Name: 2-(bromomethyl)-1,3-difluorobenzene SMILES: FC1=CC=CC(F)=C1CBr
| PubChem CID | 581435 |
|---|---|
| CAS | 85118-00-9 |
| Molecular Weight (g/mol) | 207.02 |
| MDL Number | MFCD00000329 |
| SMILES | FC1=CC=CC(F)=C1CBr |
| Synonym | 2,6-difluorobenzyl bromide,2-bromomethyl-1,3-difluorobenzene,2,6-difluorobenzylbromide,alpha-bromo-2,6-difluorotoluene,benzene, 2-bromomethyl-1,3-difluoro,timtec-bb sbb006564,2-bromomethyl-1,3-difluoro-benzene,fr cf b1e,pubchem4915,acmc-209q4j |
| IUPAC Name | 2-(bromomethyl)-1,3-difluorobenzene |
| InChI Key | LSXJPJGBWSZHTM-UHFFFAOYSA-N |
| Molecular Formula | C7H5BrF2 |
N-Benzylethanolamine, 96%
CAS: 104-63-2 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.21 MDL Number: MFCD00002840 InChI Key: XNIOWJUQPMKCIJ-UHFFFAOYSA-N Synonym: n-benzylethanolamine,2-benzylamino ethanol,benzylaminoethanol,benzylethanolamine,ethanol, 2-phenylmethyl amino,2-benzylamino ethan-1-ol,benzyl ethanolamine,n-benzyle ethanol amine,ethanol, 2-benzylamino,unii-48121ms9jm PubChem CID: 4348 IUPAC Name: 2-(benzylamino)ethanol SMILES: OCCNCC1=CC=CC=C1
| PubChem CID | 4348 |
|---|---|
| CAS | 104-63-2 |
| Molecular Weight (g/mol) | 151.21 |
| MDL Number | MFCD00002840 |
| SMILES | OCCNCC1=CC=CC=C1 |
| Synonym | n-benzylethanolamine,2-benzylamino ethanol,benzylaminoethanol,benzylethanolamine,ethanol, 2-phenylmethyl amino,2-benzylamino ethan-1-ol,benzyl ethanolamine,n-benzyle ethanol amine,ethanol, 2-benzylamino,unii-48121ms9jm |
| IUPAC Name | 2-(benzylamino)ethanol |
| InChI Key | XNIOWJUQPMKCIJ-UHFFFAOYSA-N |
| Molecular Formula | C9H13NO |
4-(Chloromethyl)benzoic acid, 96%
CAS: 1642-81-5 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.592 MDL Number: MFCD00002568 InChI Key: OITNBJHJJGMFBN-UHFFFAOYSA-N Synonym: 4-chloromethyl benzoic acid,alpha-chloro-p-toluic acid,benzoic acid, 4-chloromethyl,4-carboxybenzyl chloride,4-chloromethyl-benzoic acid,alpha-chloro-p-toluylic acid,.alpha.-chloro-p-toluylic acid,pubchem15446,alpha-chloroparatoluic acid PubChem CID: 74234 IUPAC Name: 4-(chloromethyl)benzoic acid SMILES: C1=CC(=CC=C1CCl)C(=O)O
| PubChem CID | 74234 |
|---|---|
| CAS | 1642-81-5 |
| Molecular Weight (g/mol) | 170.592 |
| MDL Number | MFCD00002568 |
| SMILES | C1=CC(=CC=C1CCl)C(=O)O |
| Synonym | 4-chloromethyl benzoic acid,alpha-chloro-p-toluic acid,benzoic acid, 4-chloromethyl,4-carboxybenzyl chloride,4-chloromethyl-benzoic acid,alpha-chloro-p-toluylic acid,.alpha.-chloro-p-toluylic acid,pubchem15446,alpha-chloroparatoluic acid |
| IUPAC Name | 4-(chloromethyl)benzoic acid |
| InChI Key | OITNBJHJJGMFBN-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
Methyl 2,4-dihydroxybenzoate, 97%
CAS: 2150-47-2 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 MDL Number: MFCD00002276 InChI Key: IIFCLXHRIYTHPV-UHFFFAOYSA-N Synonym: 2,4-dihydroxybenzoic acid methyl ester,benzoic acid, 2,4-dihydroxy-, methyl ester,methyl beta-resorcylate,methyl-2,4-dihydroxybenzoate,unii-xe68bu3oyj,xe68bu3oyj,.beta.-resorcylic acid, methyl ester,beta-resorcylic acid methyl ester,methyl benzoate, 2,4-dihydroxy,methyl b-resorcylate PubChem CID: 16523 IUPAC Name: methyl 2,4-dihydroxybenzoate SMILES: COC(=O)C1=C(C=C(C=C1)O)O
| PubChem CID | 16523 |
|---|---|
| CAS | 2150-47-2 |
| Molecular Weight (g/mol) | 168.148 |
| MDL Number | MFCD00002276 |
| SMILES | COC(=O)C1=C(C=C(C=C1)O)O |
| Synonym | 2,4-dihydroxybenzoic acid methyl ester,benzoic acid, 2,4-dihydroxy-, methyl ester,methyl beta-resorcylate,methyl-2,4-dihydroxybenzoate,unii-xe68bu3oyj,xe68bu3oyj,.beta.-resorcylic acid, methyl ester,beta-resorcylic acid methyl ester,methyl benzoate, 2,4-dihydroxy,methyl b-resorcylate |
| IUPAC Name | methyl 2,4-dihydroxybenzoate |
| InChI Key | IIFCLXHRIYTHPV-UHFFFAOYSA-N |
| Molecular Formula | C8H8O4 |