Benzene and substituted derivatives
Filtered Search Results
4-Methoxyphenylacetic acid, 98+%
CAS: 104-01-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00004345 InChI Key: NRPFNQUDKRYCNX-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid PubChem CID: 7690 ChEBI: CHEBI:55501 IUPAC Name: 2-(4-methoxyphenyl)acetic acid SMILES: COC1=CC=C(C=C1)CC(=O)O
| PubChem CID | 7690 |
|---|---|
| CAS | 104-01-8 |
| Molecular Weight (g/mol) | 166.176 |
| ChEBI | CHEBI:55501 |
| MDL Number | MFCD00004345 |
| SMILES | COC1=CC=C(C=C1)CC(=O)O |
| Synonym | 4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid |
| IUPAC Name | 2-(4-methoxyphenyl)acetic acid |
| InChI Key | NRPFNQUDKRYCNX-UHFFFAOYSA-N |
| Molecular Formula | C9H10O3 |
Folinic acid, calcium salt pentahydrate, 95.0-105.0%
CAS: 6035-45-6 Molecular Formula: C20H21CaN7O7·5H2O Molecular Weight (g/mol): 601.58 MDL Number: MFCD00149465 InChI Key: NPPBLUASYYNAIG-UHFFFAOYSA-L Synonym: folinic acid calcium pentahydrate PubChem CID: 131674093 IUPAC Name: calcium;4-[[4-[(2-amino-5-formyl-4-oxido-7,8-dihydro-6H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoate;pentahydrate SMILES: C1C(N(C2=C(N1)N=C(N=C2[O-])N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)O.O.O.O.O.O.[Ca+2]
| PubChem CID | 131674093 |
|---|---|
| CAS | 6035-45-6 |
| Molecular Weight (g/mol) | 601.58 |
| MDL Number | MFCD00149465 |
| SMILES | C1C(N(C2=C(N1)N=C(N=C2[O-])N)C=O)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)[O-])C(=O)O.O.O.O.O.O.[Ca+2] |
| Synonym | folinic acid calcium pentahydrate |
| IUPAC Name | calcium;4-[[4-[(2-amino-5-formyl-4-oxido-7,8-dihydro-6H-pteridin-6-yl)methylamino]benzoyl]amino]-5-hydroxy-5-oxopentanoate;pentahydrate |
| InChI Key | NPPBLUASYYNAIG-UHFFFAOYSA-L |
| Molecular Formula | C20H21CaN7O7·5H2O |
Folinic acid, calcium salt, 99.4%, MP Biomedicals™
CAS: 1492-18-8 Molecular Formula: C20H21CaN7O7 Molecular Weight (g/mol): 511.51 MDL Number: MFCD00006704 InChI Key: KVUAALJSMIVURS-AEQORCIRNA-L Synonym: calcium folinate PubChem CID: 131675590 SMILES: [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1
| PubChem CID | 131675590 |
|---|---|
| CAS | 1492-18-8 |
| Molecular Weight (g/mol) | 511.51 |
| MDL Number | MFCD00006704 |
| SMILES | [Ca++].NC1=NC(=O)C2=C(NCC(CNC3=CC=C(C=C3)C(=O)N[C@@H](CCC([O-])=O)C([O-])=O)N2C=O)N1 |
| Synonym | calcium folinate |
| InChI Key | KVUAALJSMIVURS-AEQORCIRNA-L |
| Molecular Formula | C20H21CaN7O7 |
2-Bromo-1,3,5-triisopropylbenzene, 96%
CAS: 21524-34-5 Molecular Formula: C15H23Br Molecular Weight (g/mol): 283.253 MDL Number: MFCD00051547 InChI Key: FUMMYHVKFAHQST-UHFFFAOYSA-N Synonym: 2-bromo-1,3,5-triisopropylbenzene,1-bromo-2,4,6-triisopropylbenzene,2,4,6-triisopropylbromobenzene,1,3,5-triisopropyl-2-bromobenzene,2-bromo-1,3,5-tris propan-2-yl benzene,2-bromo-1,3,5-triisopropyl-benzene,2-bromo-1,3,5-tri propan-2-yl benzene,benzene, 2-bromo-1,3,5-tris 1-methylethyl,2-bromo-1,3,5-tris 1-methylethyl-benzene,acmc-209flf PubChem CID: 140846 IUPAC Name: 2-bromo-1,3,5-tri(propan-2-yl)benzene SMILES: CC(C)C1=CC(=C(C(=C1)C(C)C)Br)C(C)C
| PubChem CID | 140846 |
|---|---|
| CAS | 21524-34-5 |
| Molecular Weight (g/mol) | 283.253 |
| MDL Number | MFCD00051547 |
| SMILES | CC(C)C1=CC(=C(C(=C1)C(C)C)Br)C(C)C |
| Synonym | 2-bromo-1,3,5-triisopropylbenzene,1-bromo-2,4,6-triisopropylbenzene,2,4,6-triisopropylbromobenzene,1,3,5-triisopropyl-2-bromobenzene,2-bromo-1,3,5-tris propan-2-yl benzene,2-bromo-1,3,5-triisopropyl-benzene,2-bromo-1,3,5-tri propan-2-yl benzene,benzene, 2-bromo-1,3,5-tris 1-methylethyl,2-bromo-1,3,5-tris 1-methylethyl-benzene,acmc-209flf |
| IUPAC Name | 2-bromo-1,3,5-tri(propan-2-yl)benzene |
| InChI Key | FUMMYHVKFAHQST-UHFFFAOYSA-N |
| Molecular Formula | C15H23Br |
3-Bromoanisole, 98+%
CAS: 2398-37-0 Molecular Formula: C7H7BrO Molecular Weight (g/mol): 187.04 MDL Number: MFCD00000081 InChI Key: PLDWAJLZAAHOGG-UHFFFAOYSA-N Synonym: 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole PubChem CID: 16971 IUPAC Name: 1-bromo-3-methoxybenzene SMILES: COC1=CC=CC(Br)=C1
| PubChem CID | 16971 |
|---|---|
| CAS | 2398-37-0 |
| Molecular Weight (g/mol) | 187.04 |
| MDL Number | MFCD00000081 |
| SMILES | COC1=CC=CC(Br)=C1 |
| Synonym | 3-bromoanisole,m-bromoanisole,3-methoxybromobenzene,3-bromo anisole,m-bromomethoxybenzene,benzene, 1-bromo-3-methoxy,anisole, m-bromo,3-methoxy-1-bromobenzene,m-methoxybromobenzene,meta-bromoanisole |
| IUPAC Name | 1-bromo-3-methoxybenzene |
| InChI Key | PLDWAJLZAAHOGG-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrO |
Phenylhydrazinium Chloride, Reag. Ph Eur, For Analysis, EMSURE™, MilliporeSigma™
CAS: 59-88-1 Molecular Formula: C6H9ClN2 Molecular Weight (g/mol): 144.60 MDL Number: MFCD00012924 InChI Key: JOVOSQBPPZZESK-UHFFFAOYSA-N Synonym: phenylhydrazine hydrochloride,phenylhydrazinium chloride,phenylhydrazine-hcl,phenylhydrazine monohydrochloride,phenylhydrazine hcl,hydrazine, phenyl-, monohydrochloride,unii-h7qfk49svd,phenylhydrazin hydrochlorid,phenylhydrazine.hcl,ccris 5707 PubChem CID: 60962 IUPAC Name: hydrogen phenylhydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=CC=C1
| PubChem CID | 60962 |
|---|---|
| CAS | 59-88-1 |
| Molecular Weight (g/mol) | 144.60 |
| MDL Number | MFCD00012924 |
| SMILES | [H+].[Cl-].NNC1=CC=CC=C1 |
| Synonym | phenylhydrazine hydrochloride,phenylhydrazinium chloride,phenylhydrazine-hcl,phenylhydrazine monohydrochloride,phenylhydrazine hcl,hydrazine, phenyl-, monohydrochloride,unii-h7qfk49svd,phenylhydrazin hydrochlorid,phenylhydrazine.hcl,ccris 5707 |
| IUPAC Name | hydrogen phenylhydrazine chloride |
| InChI Key | JOVOSQBPPZZESK-UHFFFAOYSA-N |
| Molecular Formula | C6H9ClN2 |
1-Bromo-4-n-propylbenzene, 99%
CAS: 588-93-2 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.091 MDL Number: MFCD00012456 InChI Key: NUPWGLKBGVNSJX-UHFFFAOYSA-N Synonym: 1-bromo-4-n-propylbenzene,4-bromo-n-propylbenzene,1-4'-bromophenyl propane,1-bromo-4-propyl-benzene,benzene, 1-bromo-4-propyl,4-propylbromobenzene,4-propyl bromobenzene,4-n-propylbromobenzene,4-propylphenyl bromide,pubchem10762 PubChem CID: 136374 IUPAC Name: 1-bromo-4-propylbenzene SMILES: CCCC1=CC=C(C=C1)Br
| PubChem CID | 136374 |
|---|---|
| CAS | 588-93-2 |
| Molecular Weight (g/mol) | 199.091 |
| MDL Number | MFCD00012456 |
| SMILES | CCCC1=CC=C(C=C1)Br |
| Synonym | 1-bromo-4-n-propylbenzene,4-bromo-n-propylbenzene,1-4'-bromophenyl propane,1-bromo-4-propyl-benzene,benzene, 1-bromo-4-propyl,4-propylbromobenzene,4-propyl bromobenzene,4-n-propylbromobenzene,4-propylphenyl bromide,pubchem10762 |
| IUPAC Name | 1-bromo-4-propylbenzene |
| InChI Key | NUPWGLKBGVNSJX-UHFFFAOYSA-N |
| Molecular Formula | C9H11Br |
4-Chloro-2,6-difluorobenzoic acid, 97%
CAS: 196194-58-8 Molecular Formula: C7H3ClF2O2 Molecular Weight (g/mol): 192.546 MDL Number: MFCD06203570 InChI Key: ZCJKTGPZLLGECQ-UHFFFAOYSA-N PubChem CID: 17750684 IUPAC Name: 4-chloro-2,6-difluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)Cl
| PubChem CID | 17750684 |
|---|---|
| CAS | 196194-58-8 |
| Molecular Weight (g/mol) | 192.546 |
| MDL Number | MFCD06203570 |
| SMILES | C1=C(C=C(C(=C1F)C(=O)O)F)Cl |
| IUPAC Name | 4-chloro-2,6-difluorobenzoic acid |
| InChI Key | ZCJKTGPZLLGECQ-UHFFFAOYSA-N |
| Molecular Formula | C7H3ClF2O2 |
2-Methylbenzotrifluoride, 97%
CAS: 13630-19-8 Molecular Formula: C8H7F3 Molecular Weight (g/mol): 160.14 MDL Number: MFCD00153204 InChI Key: DVFVNJHIVAPTMS-UHFFFAOYSA-N Synonym: 2-methylbenzotrifluoride,1-methyl-2-trifluoromethyl benzene,2-trifluoromethyl toluene,1-methyl-2-trifluoromethyl-benzene,alpha,alpha,alpha-trifluoro-o-xylene,benzene, methyl trifluoromethyl,benzene, 1-methyl-2-trifluoromethyl,2-methyl-1-trifluoromethyl benzene,trifluoromethyltoluene,pubchem1657 PubChem CID: 2775324 IUPAC Name: 1-methyl-2-(trifluoromethyl)benzene SMILES: CC1=CC=CC=C1C(F)(F)F
| PubChem CID | 2775324 |
|---|---|
| CAS | 13630-19-8 |
| Molecular Weight (g/mol) | 160.14 |
| MDL Number | MFCD00153204 |
| SMILES | CC1=CC=CC=C1C(F)(F)F |
| Synonym | 2-methylbenzotrifluoride,1-methyl-2-trifluoromethyl benzene,2-trifluoromethyl toluene,1-methyl-2-trifluoromethyl-benzene,alpha,alpha,alpha-trifluoro-o-xylene,benzene, methyl trifluoromethyl,benzene, 1-methyl-2-trifluoromethyl,2-methyl-1-trifluoromethyl benzene,trifluoromethyltoluene,pubchem1657 |
| IUPAC Name | 1-methyl-2-(trifluoromethyl)benzene |
| InChI Key | DVFVNJHIVAPTMS-UHFFFAOYSA-N |
| Molecular Formula | C8H7F3 |
4-Vinylbenzeneboronic acid, 97%
CAS: 2156-04-9 Molecular Formula: C8H9BO2 Molecular Weight (g/mol): 147.97 MDL Number: MFCD00239441 InChI Key: QWMJEUJXWVZSAG-UHFFFAOYSA-N Synonym: 4-vinylphenylboronic acid,4-vinylbenzeneboronic acid,4-vinylphenyl boronic acid,4-ethenylphenyl boronic acid,4-vinylboronic acid,p-styrylboronic acid,p-vinylphenylboronic acid,styrene-4-boronic acid,boronic acid, 4-ethenylphenyl,4-styreneboronic acid PubChem CID: 2734393 IUPAC Name: (4-ethenylphenyl)boronic acid SMILES: OB(O)C1=CC=C(C=C)C=C1
| PubChem CID | 2734393 |
|---|---|
| CAS | 2156-04-9 |
| Molecular Weight (g/mol) | 147.97 |
| MDL Number | MFCD00239441 |
| SMILES | OB(O)C1=CC=C(C=C)C=C1 |
| Synonym | 4-vinylphenylboronic acid,4-vinylbenzeneboronic acid,4-vinylphenyl boronic acid,4-ethenylphenyl boronic acid,4-vinylboronic acid,p-styrylboronic acid,p-vinylphenylboronic acid,styrene-4-boronic acid,boronic acid, 4-ethenylphenyl,4-styreneboronic acid |
| IUPAC Name | (4-ethenylphenyl)boronic acid |
| InChI Key | QWMJEUJXWVZSAG-UHFFFAOYSA-N |
| Molecular Formula | C8H9BO2 |
Sulfosalicylic Acid, Dihydrate, Crystal, BAKER ANALYZED™ A.C.S. Reagent, J.T. Baker™
CAS: 5965-83-3 Molecular Formula: C9H14O6S Molecular Weight (g/mol): 250.27 MDL Number: MFCD00007508,MFCD00149540 InChI Key: NFYHZVWMQHQKRU-UHFFFAOYSA-N 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 PubChem CID: 2723734 SMILES: C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O
| PubChem CID | 2723734 |
|---|---|
| CAS | 5965-83-3 |
| Molecular Weight (g/mol) | 250.27 |
| MDL Number | MFCD00007508,MFCD00149540 |
| SMILES | C.C.OC(=O)C1=CC(=CC=C1O)S(O)(=O)=O |
| 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 |
| InChI Key | NFYHZVWMQHQKRU-UHFFFAOYSA-N |
| Molecular Formula | C9H14O6S |
3-Chloro-2-methylanisole, 97%
CAS: 3260-88-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00070772 InChI Key: LTVRGAWOEOKGJZ-UHFFFAOYSA-N Synonym: 3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa PubChem CID: 76749 IUPAC Name: 1-chloro-3-methoxy-2-methylbenzene SMILES: COC1=CC=CC(Cl)=C1C
| PubChem CID | 76749 |
|---|---|
| CAS | 3260-88-6 |
| Molecular Weight (g/mol) | 156.61 |
| MDL Number | MFCD00070772 |
| SMILES | COC1=CC=CC(Cl)=C1C |
| Synonym | 3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa |
| IUPAC Name | 1-chloro-3-methoxy-2-methylbenzene |
| InChI Key | LTVRGAWOEOKGJZ-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
3-Bromo-4-chloroanisole, 98%
CAS: 2732-80-1 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.48 MDL Number: MFCD00070739 InChI Key: SQHMXVXKKCXIGN-UHFFFAOYSA-N Synonym: 3-bromo-4-chloroanisole,4-chloro-3-bromoanisole,2-chloro-5-methoxybromobenzene,benzene, 2-bromo-1-chloro-4-methoxy,3-bromo-4-chlorophenyl methyl ether,pubchem4555,acmc-1clwv,3-bromo-4-chloroamizole,ksc497k1d,2-chloro-5-methoxy-bromobenzene PubChem CID: 24212081 IUPAC Name: 2-bromo-1-chloro-4-methoxybenzene SMILES: COC1=CC(Br)=C(Cl)C=C1
| PubChem CID | 24212081 |
|---|---|
| CAS | 2732-80-1 |
| Molecular Weight (g/mol) | 221.48 |
| MDL Number | MFCD00070739 |
| SMILES | COC1=CC(Br)=C(Cl)C=C1 |
| Synonym | 3-bromo-4-chloroanisole,4-chloro-3-bromoanisole,2-chloro-5-methoxybromobenzene,benzene, 2-bromo-1-chloro-4-methoxy,3-bromo-4-chlorophenyl methyl ether,pubchem4555,acmc-1clwv,3-bromo-4-chloroamizole,ksc497k1d,2-chloro-5-methoxy-bromobenzene |
| IUPAC Name | 2-bromo-1-chloro-4-methoxybenzene |
| InChI Key | SQHMXVXKKCXIGN-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO |
Eugenol, USP, Spectrum™ Chemical
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CAS: 97-53-0 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00008654 InChI Key: RRAFCDWBNXTKKO-UHFFFAOYSA-N IUPAC Name: 2-methoxy-4-(prop-2-en-1-yl)phenol SMILES: COC1=CC(CC=C)=CC=C1O
| CAS | 97-53-0 |
|---|---|
| Molecular Weight (g/mol) | 164.20 |
| MDL Number | MFCD00008654 |
| SMILES | COC1=CC(CC=C)=CC=C1O |
| IUPAC Name | 2-methoxy-4-(prop-2-en-1-yl)phenol |
| InChI Key | RRAFCDWBNXTKKO-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
3,4,5-Trimethoxytoluene, 98%
CAS: 6443-69-2 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00008397 InChI Key: KCIZTNZGSBSSRM-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxytoluene,benzene, 1,2,3-trimethoxy-5-methyl,5-methylpyrogallol trimethyl ether,1,2,3-trimethoxy-5-methyl-benzene,toluene, 3,4,5-trimethoxy,1,2,3-trimethoxy-5-methylbenzol,pubchem13665,acmc-209nm4,3,4,5-trimethoxy-toluene,3,4,5-trimethoxy toluene PubChem CID: 80922 ChEBI: CHEBI:81354 IUPAC Name: 1,2,3-trimethoxy-5-methylbenzene SMILES: CC1=CC(=C(C(=C1)OC)OC)OC
| PubChem CID | 80922 |
|---|---|
| CAS | 6443-69-2 |
| Molecular Weight (g/mol) | 182.219 |
| ChEBI | CHEBI:81354 |
| MDL Number | MFCD00008397 |
| SMILES | CC1=CC(=C(C(=C1)OC)OC)OC |
| Synonym | 3,4,5-trimethoxytoluene,benzene, 1,2,3-trimethoxy-5-methyl,5-methylpyrogallol trimethyl ether,1,2,3-trimethoxy-5-methyl-benzene,toluene, 3,4,5-trimethoxy,1,2,3-trimethoxy-5-methylbenzol,pubchem13665,acmc-209nm4,3,4,5-trimethoxy-toluene,3,4,5-trimethoxy toluene |
| IUPAC Name | 1,2,3-trimethoxy-5-methylbenzene |
| InChI Key | KCIZTNZGSBSSRM-UHFFFAOYSA-N |
| Molecular Formula | C10H14O3 |