Benzenoids
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(+/-)-BINAP 97.0+%, TCI America™
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CAS: 98327-87-8 Molecular Formula: C44H32P2 Molecular Weight (g/mol): 622.69 MDL Number: MFCD00010805 InChI Key: MUALRAIOVNYAIW-UHFFFAOYSA-N Synonym: binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene PubChem CID: 634876 IUPAC Name: [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=C(C2=CC=CC=C2C=C1)C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 634876 |
|---|---|
| CAS | 98327-87-8 |
| Molecular Weight (g/mol) | 622.69 |
| MDL Number | MFCD00010805 |
| SMILES | C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=C(C2=CC=CC=C2C=C1)C1=C(C=CC2=CC=CC=C12)P(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | binap,r-+-2,2'-bis diphenylphosphino-1,1'-binaphthyl,2,2'-bis diphenylphosphino-1,1'-binaphthyl,s-binap,s---binap,s---2,2'-bis diphenylphosphino-1,1'-binaphthyl,r-+-binap,r-binap,rac-binap,2,2'-bis diphenylphosphino-1,1'-binaphthalene |
| IUPAC Name | [2'-(diphenylphosphanyl)-[1,1'-binaphthalen]-2-yl]diphenylphosphane |
| InChI Key | MUALRAIOVNYAIW-UHFFFAOYSA-N |
| Molecular Formula | C44H32P2 |
Ethyl Benzilate 97.0+%, TCI America™
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CAS: 52182-15-7 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.30 MDL Number: MFCD00016850 InChI Key: AIPVNQQMYPWQSX-UHFFFAOYSA-N Synonym: ethyl benzilate,benzilic acid ethyl ester,ethyl diphenylglycolate,ethylbenzilate,ethyl benzillate,benzeneacetic acid, .alpha.-hydroxy-.alpha.-phenyl-, ethyl ester,benzilsaureethylester,acmc-209ky4,ethyl hydroxy diphenyl acetate #,diphenylglycolic acid ethyl ester PubChem CID: 96261 IUPAC Name: ethyl 2-hydroxy-2,2-diphenylacetate SMILES: CCOC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 96261 |
|---|---|
| CAS | 52182-15-7 |
| Molecular Weight (g/mol) | 256.30 |
| MDL Number | MFCD00016850 |
| SMILES | CCOC(=O)C(O)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | ethyl benzilate,benzilic acid ethyl ester,ethyl diphenylglycolate,ethylbenzilate,ethyl benzillate,benzeneacetic acid, .alpha.-hydroxy-.alpha.-phenyl-, ethyl ester,benzilsaureethylester,acmc-209ky4,ethyl hydroxy diphenyl acetate #,diphenylglycolic acid ethyl ester |
| IUPAC Name | ethyl 2-hydroxy-2,2-diphenylacetate |
| InChI Key | AIPVNQQMYPWQSX-UHFFFAOYSA-N |
| Molecular Formula | C16H16O3 |
1-Bromo-4-dodecylbenzene 90.0+%, TCI America™
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CAS: 126930-72-1 Molecular Formula: C18H29Br Molecular Weight (g/mol): 325.334 MDL Number: MFCD00191386 InChI Key: RFFMRBISTZHCNY-UHFFFAOYSA-N Synonym: 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene PubChem CID: 15120506 IUPAC Name: 1-bromo-4-dodecylbenzene SMILES: CCCCCCCCCCCCC1=CC=C(C=C1)Br
| PubChem CID | 15120506 |
|---|---|
| CAS | 126930-72-1 |
| Molecular Weight (g/mol) | 325.334 |
| MDL Number | MFCD00191386 |
| SMILES | CCCCCCCCCCCCC1=CC=C(C=C1)Br |
| Synonym | 4-dodecylbromobenzene,1-bromo-4-n-dodecylbenzene,benzene, 1-bromo-4-dodecyl,4-bromododecylbenzene,pubchem22735,acmc-209bby,1-bromo-4-dodecyl-benzene,ksc494g6d,4-n-dodecylbromobenzene |
| IUPAC Name | 1-bromo-4-dodecylbenzene |
| InChI Key | RFFMRBISTZHCNY-UHFFFAOYSA-N |
| Molecular Formula | C18H29Br |
Tetraphenylphosphonium Iodide 98.0+%, TCI America™
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CAS: 2065-67-0 Molecular Formula: C24H20IP Molecular Weight (g/mol): 466.30 MDL Number: MFCD00011917 InChI Key: AEFPPQGZJFTXDR-UHFFFAOYSA-M Synonym: tetraphenylphosphonium iodide,tetraphenylphosphoniumiodide,tetraphenylphosphanium iodide,acmc-1cpca PubChem CID: 2724164 IUPAC Name: tetraphenylphosphanium iodide SMILES: [I-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 2724164 |
|---|---|
| CAS | 2065-67-0 |
| Molecular Weight (g/mol) | 466.30 |
| MDL Number | MFCD00011917 |
| SMILES | [I-].C1=CC=C(C=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | tetraphenylphosphonium iodide,tetraphenylphosphoniumiodide,tetraphenylphosphanium iodide,acmc-1cpca |
| IUPAC Name | tetraphenylphosphanium iodide |
| InChI Key | AEFPPQGZJFTXDR-UHFFFAOYSA-M |
| Molecular Formula | C24H20IP |
4-[(2,4-Dimethoxyphenyl)[(9H-fluoren-9-ylmethoxy)carbonylamino]methyl]phenoxyacetic Acid 98.0+%, TCI America™
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CAS: 126828-35-1 Molecular Formula: C32H29NO7 Molecular Weight (g/mol): 539.584 MDL Number: MFCD00153509 InChI Key: UPMGJEMWPQOACJ-UHFFFAOYSA-N Synonym: 4-[(2,4-Dimethoxyphenyl)(Fmoc-amino)methyl]phenoxyacetic Acid PubChem CID: 2761459 IUPAC Name: 2-[4-[(2,4-dimethoxyphenyl)-(9H-fluoren-9-ylmethoxycarbonylamino)methyl]phenoxy]acetic acid SMILES: COC1=CC(=C(C=C1)C(C2=CC=C(C=C2)OCC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)OC
| PubChem CID | 2761459 |
|---|---|
| CAS | 126828-35-1 |
| Molecular Weight (g/mol) | 539.584 |
| MDL Number | MFCD00153509 |
| SMILES | COC1=CC(=C(C=C1)C(C2=CC=C(C=C2)OCC(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)OC |
| Synonym | 4-[(2,4-Dimethoxyphenyl)(Fmoc-amino)methyl]phenoxyacetic Acid |
| IUPAC Name | 2-[4-[(2,4-dimethoxyphenyl)-(9H-fluoren-9-ylmethoxycarbonylamino)methyl]phenoxy]acetic acid |
| InChI Key | UPMGJEMWPQOACJ-UHFFFAOYSA-N |
| Molecular Formula | C32H29NO7 |
3',4'-Dimethylacetanilide 98.0+%, TCI America™
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CAS: 2198-54-1 Molecular Formula: C10H13NO Molecular Weight (g/mol): 163.22 MDL Number: MFCD00026137 InChI Key: UAOIEEWQVAXCFY-UHFFFAOYSA-N Synonym: 3',4'-dimethylacetanilide,n-3,4-dimethylphenyl acetamide,3,4-dimethylacetanilide,n-acetyl-3,4-xylidine,3',4'-acetoxylidide,acetamide, n-3,4-dimethylphenyl,3',4'-acetoxylide,acetamide, n-3,4-dimethylphenyl-9ci,4-acetamino-o-xylol,aceto-3,4-xylidide PubChem CID: 75144 IUPAC Name: N-(3,4-dimethylphenyl)acetamide SMILES: CC1=C(C=C(C=C1)NC(=O)C)C
| PubChem CID | 75144 |
|---|---|
| CAS | 2198-54-1 |
| Molecular Weight (g/mol) | 163.22 |
| MDL Number | MFCD00026137 |
| SMILES | CC1=C(C=C(C=C1)NC(=O)C)C |
| Synonym | 3',4'-dimethylacetanilide,n-3,4-dimethylphenyl acetamide,3,4-dimethylacetanilide,n-acetyl-3,4-xylidine,3',4'-acetoxylidide,acetamide, n-3,4-dimethylphenyl,3',4'-acetoxylide,acetamide, n-3,4-dimethylphenyl-9ci,4-acetamino-o-xylol,aceto-3,4-xylidide |
| IUPAC Name | N-(3,4-dimethylphenyl)acetamide |
| InChI Key | UAOIEEWQVAXCFY-UHFFFAOYSA-N |
| Molecular Formula | C10H13NO |
N-(2-Aminoethyl)-N-ethyl-m-toluidine 98.0+%, TCI America™
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CAS: 19248-13-6 Molecular Formula: C11H18N2 Molecular Weight (g/mol): 178.28 MDL Number: MFCD00025603 InChI Key: FTMVEUXYYDLYFH-UHFFFAOYSA-N PubChem CID: 87984 IUPAC Name: N-(2-aminoethyl)-N-ethyl-3-methylaniline SMILES: CCN(CCN)C1=CC=CC(C)=C1
| PubChem CID | 87984 |
|---|---|
| CAS | 19248-13-6 |
| Molecular Weight (g/mol) | 178.28 |
| MDL Number | MFCD00025603 |
| SMILES | CCN(CCN)C1=CC=CC(C)=C1 |
| IUPAC Name | N-(2-aminoethyl)-N-ethyl-3-methylaniline |
| InChI Key | FTMVEUXYYDLYFH-UHFFFAOYSA-N |
| Molecular Formula | C11H18N2 |
2,6-Difluoroanisole 97.0+%, TCI America™
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CAS: 437-82-1 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.121 InChI Key: IOBWAHRFIPQEQL-UHFFFAOYSA-N Synonym: 2,6-difluoroanisole,1,3-difluoro-2-methoxy-benzene,benzene, 1,3-difluoro-2-methoxy,pubchem1968,2,6-difluoro anisole,2.6-difluoro anisole,acmc-1ajjj,ksc235o3h,iobwahrfipqeql-uhfffaoysa PubChem CID: 2736897 IUPAC Name: 1,3-difluoro-2-methoxybenzene SMILES: COC1=C(C=CC=C1F)F
| PubChem CID | 2736897 |
|---|---|
| CAS | 437-82-1 |
| Molecular Weight (g/mol) | 144.121 |
| SMILES | COC1=C(C=CC=C1F)F |
| Synonym | 2,6-difluoroanisole,1,3-difluoro-2-methoxy-benzene,benzene, 1,3-difluoro-2-methoxy,pubchem1968,2,6-difluoro anisole,2.6-difluoro anisole,acmc-1ajjj,ksc235o3h,iobwahrfipqeql-uhfffaoysa |
| IUPAC Name | 1,3-difluoro-2-methoxybenzene |
| InChI Key | IOBWAHRFIPQEQL-UHFFFAOYSA-N |
| Molecular Formula | C7H6F2O |
Ambroxol Hydrochloride 98.0+%, TCI America™
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CAS: 23828-92-4 Molecular Formula: C13H19Br2ClN2O Molecular Weight (g/mol): 414.57 MDL Number: MFCD00078932 InChI Key: QNVKOSLOVOTXKF-UHFFFAOYSA-N Synonym: ambroxol hydrochloride,ambroxol hcl,mucoangin,mucosolvan,ambroxolhydrochloride,unii-cc995zmv90,cis-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,trans-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,ambroxol hydrochloride jan,lasolvan PubChem CID: 108013 IUPAC Name: hydrogen 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}cyclohexan-1-ol chloride SMILES: [H+].[Cl-].NC1=C(Br)C=C(Br)C=C1CNC1CCC(O)CC1
| PubChem CID | 108013 |
|---|---|
| CAS | 23828-92-4 |
| Molecular Weight (g/mol) | 414.57 |
| MDL Number | MFCD00078932 |
| SMILES | [H+].[Cl-].NC1=C(Br)C=C(Br)C=C1CNC1CCC(O)CC1 |
| Synonym | ambroxol hydrochloride,ambroxol hcl,mucoangin,mucosolvan,ambroxolhydrochloride,unii-cc995zmv90,cis-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,trans-4-2-amino-3,5-dibromobenzyl amino cyclohexanol hydrochloride,ambroxol hydrochloride jan,lasolvan |
| IUPAC Name | hydrogen 4-{[(2-amino-3,5-dibromophenyl)methyl]amino}cyclohexan-1-ol chloride |
| InChI Key | QNVKOSLOVOTXKF-UHFFFAOYSA-N |
| Molecular Formula | C13H19Br2ClN2O |
N-(p-Toluenesulfonyl)glycine 98.0+%, TCI America™
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CAS: 1080-44-0 Molecular Formula: C9H11NO4S Molecular Weight (g/mol): 229.25 MDL Number: MFCD00045898 InChI Key: VDKFCCZUCXYILI-UHFFFAOYSA-N Synonym: n-p-tosylglycine,tos-gly-oh,n-tosylglycine,2-4-methylphenylsulfonamido acetic acid,n-4-methylphenyl sulfonyl glycine,n-p-toluenesulfonyl glycine,n-4-tosylglycine,glycine, n-4-methylphenyl sulfonyl,n-toluene-4-sulfonyl-glycine,toluene-4-sulfonylamino-acetic acid PubChem CID: 70653 IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]acetic acid SMILES: CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O
| PubChem CID | 70653 |
|---|---|
| CAS | 1080-44-0 |
| Molecular Weight (g/mol) | 229.25 |
| MDL Number | MFCD00045898 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)O |
| Synonym | n-p-tosylglycine,tos-gly-oh,n-tosylglycine,2-4-methylphenylsulfonamido acetic acid,n-4-methylphenyl sulfonyl glycine,n-p-toluenesulfonyl glycine,n-4-tosylglycine,glycine, n-4-methylphenyl sulfonyl,n-toluene-4-sulfonyl-glycine,toluene-4-sulfonylamino-acetic acid |
| IUPAC Name | 2-[(4-methylphenyl)sulfonylamino]acetic acid |
| InChI Key | VDKFCCZUCXYILI-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO4S |
Cholesterol Benzoate 96.0+%, TCI America™
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CAS: 604-32-0 Molecular Formula: C34H50O2 Molecular Weight (g/mol): 490.77 MDL Number: MFCD00003635 InChI Key: UVZUFUGNHDDLRQ-UHFFFAOYNA-N Synonym: cholesteryl benzoate,cholesterol benzoate,3b-benzoyloxy cholest-5-ene,unii-n09h13shlb,n09h13shlb,cholest-5-ene-3-beta-yl benzoate,cholest-5-en-3-ol 3.beta.-, benzoate,5-cholesten-3.beta.-ol benzoate,cholest-5-en-3-ol 3beta-, benzoate PubChem CID: 2723613 IUPAC Name: 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl benzoate SMILES: CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1=CC=CC=C1
| PubChem CID | 2723613 |
|---|---|
| CAS | 604-32-0 |
| Molecular Weight (g/mol) | 490.77 |
| MDL Number | MFCD00003635 |
| SMILES | CC(C)CCCC(C)C1CCC2C3CC=C4CC(CCC4(C)C3CCC12C)OC(=O)C1=CC=CC=C1 |
| Synonym | cholesteryl benzoate,cholesterol benzoate,3b-benzoyloxy cholest-5-ene,unii-n09h13shlb,n09h13shlb,cholest-5-ene-3-beta-yl benzoate,cholest-5-en-3-ol 3.beta.-, benzoate,5-cholesten-3.beta.-ol benzoate,cholest-5-en-3-ol 3beta-, benzoate |
| IUPAC Name | 9a,11a-dimethyl-1-(6-methylheptan-2-yl)-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl benzoate |
| InChI Key | UVZUFUGNHDDLRQ-UHFFFAOYNA-N |
| Molecular Formula | C34H50O2 |
Tyrphostin A23 98.0+%, TCI America™
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3,5-Bis(trifluoromethyl)phenol 96.0+%, TCI America™
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CAS: 349-58-6 Molecular Formula: C8H4F6O Molecular Weight (g/mol): 230.109 MDL Number: MFCD00000386 InChI Key: ODSXJQYJADZFJX-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenol,phenol, 3,5-bis trifluoromethyl,3,5-di trifluoromethyl phenol,3,5-bis-trifluoromethylphenol,3,5-ditrifluoromethylphenol,3,5-bis-trifluoromethyl phenol,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylenol,pubchem12483,mbt-oh,acmc-1clsr PubChem CID: 67680 IUPAC Name: 3,5-bis(trifluoromethyl)phenol SMILES: C1=C(C=C(C=C1C(F)(F)F)O)C(F)(F)F
| PubChem CID | 67680 |
|---|---|
| CAS | 349-58-6 |
| Molecular Weight (g/mol) | 230.109 |
| MDL Number | MFCD00000386 |
| SMILES | C1=C(C=C(C=C1C(F)(F)F)O)C(F)(F)F |
| Synonym | 3,5-bis trifluoromethyl phenol,phenol, 3,5-bis trifluoromethyl,3,5-di trifluoromethyl phenol,3,5-bis-trifluoromethylphenol,3,5-ditrifluoromethylphenol,3,5-bis-trifluoromethyl phenol,alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylenol,pubchem12483,mbt-oh,acmc-1clsr |
| IUPAC Name | 3,5-bis(trifluoromethyl)phenol |
| InChI Key | ODSXJQYJADZFJX-UHFFFAOYSA-N |
| Molecular Formula | C8H4F6O |
3,5-Difluorobenzyl Alcohol 98.0+%, TCI America™
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CAS: 79538-20-8 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.121 MDL Number: MFCD00010313 InChI Key: LOGIHEKXJKHXEC-UHFFFAOYSA-N Synonym: 3,5-difluorobenzyl alcohol,3,5-difluorophenyl methanol,benzenemethanol, 3,5-difluoro,3,5-difluorophenyl methan-1-ol,3,5-difluorobenzylalcohol,3, 5-difluorobenzyl alcohol,pubchem4918,acmc-1baxh,ksc493g5j,3,5-difluoro-phenyl methanol PubChem CID: 522721 IUPAC Name: (3,5-difluorophenyl)methanol SMILES: C1=C(C=C(C=C1F)F)CO
| PubChem CID | 522721 |
|---|---|
| CAS | 79538-20-8 |
| Molecular Weight (g/mol) | 144.121 |
| MDL Number | MFCD00010313 |
| SMILES | C1=C(C=C(C=C1F)F)CO |
| Synonym | 3,5-difluorobenzyl alcohol,3,5-difluorophenyl methanol,benzenemethanol, 3,5-difluoro,3,5-difluorophenyl methan-1-ol,3,5-difluorobenzylalcohol,3, 5-difluorobenzyl alcohol,pubchem4918,acmc-1baxh,ksc493g5j,3,5-difluoro-phenyl methanol |
| IUPAC Name | (3,5-difluorophenyl)methanol |
| InChI Key | LOGIHEKXJKHXEC-UHFFFAOYSA-N |
| Molecular Formula | C7H6F2O |
Dimethyl Terephthalate 99.0+%, TCI America™
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CAS: 120-61-6 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00008440 InChI Key: WOZVHXUHUFLZGK-UHFFFAOYSA-N Synonym: dimethyl terephthalate,dimethyl p-phthalate,1,4-benzenedicarboxylic acid, dimethyl ester,dimethyl p-benzenedicarboxylate,di-me terephthalate,dimethyl 4-phthalate,terephthalic acid, dimethyl ester,dimethyl 1,4-benzenedicarboxylate,terephthalic acid dimethyl ester,methyl p-methoxycarbonyl benzoate PubChem CID: 8441 IUPAC Name: 1,4-dimethyl benzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC=C(C=C1)C(=O)OC
| PubChem CID | 8441 |
|---|---|
| CAS | 120-61-6 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD00008440 |
| SMILES | COC(=O)C1=CC=C(C=C1)C(=O)OC |
| Synonym | dimethyl terephthalate,dimethyl p-phthalate,1,4-benzenedicarboxylic acid, dimethyl ester,dimethyl p-benzenedicarboxylate,di-me terephthalate,dimethyl 4-phthalate,terephthalic acid, dimethyl ester,dimethyl 1,4-benzenedicarboxylate,terephthalic acid dimethyl ester,methyl p-methoxycarbonyl benzoate |
| IUPAC Name | 1,4-dimethyl benzene-1,4-dicarboxylate |
| InChI Key | WOZVHXUHUFLZGK-UHFFFAOYSA-N |
| Molecular Formula | C10H10O4 |