Benzenoids
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4-Benzylphenol, Spectrum™ Chemical
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CAS: 101-53-1 Molecular Formula: C13H12O Molecular Weight (g/mol): 184.24 InChI Key: HJSPWKGEPDZNLK-UHFFFAOYSA-N IUPAC Name: 4-benzylphenol SMILES: OC1=CC=C(CC2=CC=CC=C2)C=C1
| CAS | 101-53-1 |
|---|---|
| Molecular Weight (g/mol) | 184.24 |
| SMILES | OC1=CC=C(CC2=CC=CC=C2)C=C1 |
| IUPAC Name | 4-benzylphenol |
| InChI Key | HJSPWKGEPDZNLK-UHFFFAOYSA-N |
| Molecular Formula | C13H12O |
Hexadimethrine Bromide, Spectrum™ Chemical
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CAS: 28728-55-4
| CAS | 28728-55-4 |
|---|
2-Nitrobenzaldehyde, Spectrum™ Chemical
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CAS: 552-89-6
| CAS | 552-89-6 |
|---|
2-Amino-6-methoxybenzoic acid, 97%
CAS: 53600-33-2 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD01941328 InChI Key: DYZDIWNRWSNVPT-UHFFFAOYSA-N Synonym: 6-methoxyanthranilic acid,6-amino-o-anisic acid,2-amino-6-methoxy-benzoic acid,2-amino-6-methoxybenzoicacid,benzoic acid, 2-amino-6-methoxy,6-methoxy anthranilic acid,pubchem4706,3-amino-2-carboxyanisole,6-methoxy-anthranilic acid,2-carboxy-3-methoxyaniline PubChem CID: 2735357 IUPAC Name: 2-amino-6-methoxybenzoic acid SMILES: COC1=CC=CC(=C1C(=O)O)N
| PubChem CID | 2735357 |
|---|---|
| CAS | 53600-33-2 |
| Molecular Weight (g/mol) | 167.164 |
| MDL Number | MFCD01941328 |
| SMILES | COC1=CC=CC(=C1C(=O)O)N |
| Synonym | 6-methoxyanthranilic acid,6-amino-o-anisic acid,2-amino-6-methoxy-benzoic acid,2-amino-6-methoxybenzoicacid,benzoic acid, 2-amino-6-methoxy,6-methoxy anthranilic acid,pubchem4706,3-amino-2-carboxyanisole,6-methoxy-anthranilic acid,2-carboxy-3-methoxyaniline |
| IUPAC Name | 2-amino-6-methoxybenzoic acid |
| InChI Key | DYZDIWNRWSNVPT-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO3 |
2-Amino-5-fluorobenzoic acid, 97%
CAS: 446-08-2 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD00055566 InChI Key: FPQMGQZTBWIHDN-UHFFFAOYSA-N Synonym: 5-fluoroanthranilic acid,2-amino-5-fluoro-benzoic acid,benzoic acid, 2-amino-5-fluoro,5-faa,5-fluoro-2-aminobenzoic acid,4own,5rg,pubchem1322,5-fluoroanthanilic acid,acmc-209jyo PubChem CID: 101412 ChEBI: CHEBI:78042 IUPAC Name: 2-amino-5-fluorobenzoic acid SMILES: C1=CC(=C(C=C1F)C(=O)O)N
| PubChem CID | 101412 |
|---|---|
| CAS | 446-08-2 |
| Molecular Weight (g/mol) | 155.128 |
| ChEBI | CHEBI:78042 |
| MDL Number | MFCD00055566 |
| SMILES | C1=CC(=C(C=C1F)C(=O)O)N |
| Synonym | 5-fluoroanthranilic acid,2-amino-5-fluoro-benzoic acid,benzoic acid, 2-amino-5-fluoro,5-faa,5-fluoro-2-aminobenzoic acid,4own,5rg,pubchem1322,5-fluoroanthanilic acid,acmc-209jyo |
| IUPAC Name | 2-amino-5-fluorobenzoic acid |
| InChI Key | FPQMGQZTBWIHDN-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO2 |
3-Amino-4-methoxybenzamide, 98%
CAS: 17481-27-5 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00017132 InChI Key: INCJNDAQNPWMPZ-UHFFFAOYSA-N Synonym: benzamide, 3-amino-4-methoxy,3-amino-p-anisamide,3-amino-4-methoxy-benzamide,3-amino-4-methoxy benzamide,acmc-209e8v,5-amino-4-methoxybenzamide,cambridge id 5306680,ksc495o3j,incjndaqnpwmpz-uhfffaoysa PubChem CID: 87135 IUPAC Name: 3-amino-4-methoxybenzamide SMILES: COC1=C(C=C(C=C1)C(=O)N)N
| PubChem CID | 87135 |
|---|---|
| CAS | 17481-27-5 |
| Molecular Weight (g/mol) | 166.18 |
| MDL Number | MFCD00017132 |
| SMILES | COC1=C(C=C(C=C1)C(=O)N)N |
| Synonym | benzamide, 3-amino-4-methoxy,3-amino-p-anisamide,3-amino-4-methoxy-benzamide,3-amino-4-methoxy benzamide,acmc-209e8v,5-amino-4-methoxybenzamide,cambridge id 5306680,ksc495o3j,incjndaqnpwmpz-uhfffaoysa |
| IUPAC Name | 3-amino-4-methoxybenzamide |
| InChI Key | INCJNDAQNPWMPZ-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2O2 |
4-Amino-3-fluorobenzoic acid, 98%, Thermo Scientific Chemicals
CAS: 455-87-8 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01660374 InChI Key: JSKXHTHMCCDEGD-UHFFFAOYSA-N Synonym: 3-fluoro-4-aminobenzoic acid,benzoic acid, 4-amino-3-fluoro,4-amino-3-fluorobenzenecarboxylic acid,4-amino-3-fluoro-benzoic acid,4-amino-3-fluorobenzoicacid,pubchem3524,wln: zr bf dvq,acmc-209k3i,3-14-00-01153 beilstein handbook reference,buttpark 44\09-60 PubChem CID: 9971 IUPAC Name: 4-amino-3-fluorobenzoic acid SMILES: C1=CC(=C(C=C1C(=O)O)F)N
| PubChem CID | 9971 |
|---|---|
| CAS | 455-87-8 |
| Molecular Weight (g/mol) | 155.128 |
| MDL Number | MFCD01660374 |
| SMILES | C1=CC(=C(C=C1C(=O)O)F)N |
| Synonym | 3-fluoro-4-aminobenzoic acid,benzoic acid, 4-amino-3-fluoro,4-amino-3-fluorobenzenecarboxylic acid,4-amino-3-fluoro-benzoic acid,4-amino-3-fluorobenzoicacid,pubchem3524,wln: zr bf dvq,acmc-209k3i,3-14-00-01153 beilstein handbook reference,buttpark 44\09-60 |
| IUPAC Name | 4-amino-3-fluorobenzoic acid |
| InChI Key | JSKXHTHMCCDEGD-UHFFFAOYSA-N |
| Molecular Formula | C7H6FNO2 |
3-Bromocatechol, 95%
CAS: 14381-51-2 Molecular Formula: C6H5BrO2 Molecular Weight (g/mol): 189.008 MDL Number: MFCD00869768 InChI Key: JPBDMIWPTFDFEU-UHFFFAOYSA-N Synonym: 3-bromocatechol,3-bromopyrocatechol,1-bromo-2,3-dihydroxybenzene,1,2-benzenediol, 3-bromo,benzenediol, bromo,3-bromo-1,2-benzenediol,2,3-dihydroxy-bromobenzene,bromocatechol,3-bromoatechol,pubchem19085 PubChem CID: 26659 IUPAC Name: 3-bromobenzene-1,2-diol SMILES: C1=CC(=C(C(=C1)Br)O)O
| PubChem CID | 26659 |
|---|---|
| CAS | 14381-51-2 |
| Molecular Weight (g/mol) | 189.008 |
| MDL Number | MFCD00869768 |
| SMILES | C1=CC(=C(C(=C1)Br)O)O |
| Synonym | 3-bromocatechol,3-bromopyrocatechol,1-bromo-2,3-dihydroxybenzene,1,2-benzenediol, 3-bromo,benzenediol, bromo,3-bromo-1,2-benzenediol,2,3-dihydroxy-bromobenzene,bromocatechol,3-bromoatechol,pubchem19085 |
| IUPAC Name | 3-bromobenzene-1,2-diol |
| InChI Key | JPBDMIWPTFDFEU-UHFFFAOYSA-N |
| Molecular Formula | C6H5BrO2 |
3-Fluoro-1,2-dihydroxybenzene, 98+%, Thermo Scientific Chemicals
CAS: 363-52-0 Molecular Formula: C6H5FO2 Molecular Weight (g/mol): 128.10 MDL Number: MFCD00042582 InChI Key: DXOSJQLIRGXWCF-UHFFFAOYSA-N Synonym: 3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142 PubChem CID: 67764 ChEBI: CHEBI:39876 IUPAC Name: 3-fluorobenzene-1,2-diol SMILES: OC1=CC=CC(F)=C1O
| PubChem CID | 67764 |
|---|---|
| CAS | 363-52-0 |
| Molecular Weight (g/mol) | 128.10 |
| ChEBI | CHEBI:39876 |
| MDL Number | MFCD00042582 |
| SMILES | OC1=CC=CC(F)=C1O |
| Synonym | 3-fluorocatechol,pyrocatechol, 3-fluoro,1,2-benzenediol, 3-fluoro,1,2-dihydroxy-3-fluorobenzene,3-fluoro-1,2-dihydroxybenzene,3-fluoro-1,2-benzenediol,1-fluoro-2,3-dihydroxybenzene,3fa,pubchem4142 |
| IUPAC Name | 3-fluorobenzene-1,2-diol |
| InChI Key | DXOSJQLIRGXWCF-UHFFFAOYSA-N |
| Molecular Formula | C6H5FO2 |
Phenylethyl 3,4-dihydroxycinnamate, 98+%
CAS: 104594-70-9 Molecular Formula: C17H16O4 Molecular Weight (g/mol): 284.31 MDL Number: MFCD00866470 InChI Key: SWUARLUWKZWEBQ-VQHVLOKHSA-N Synonym: caffeic acid phenethyl ester,phenethyl caffeate,cape,capeee,phenethyl 3-3,4-dihydroxyphenyl acrylate,phenylethyl caffeate,unii-g960r9s5sk,caffeic acid phenylethyl ester,2-phenylethyl caffeate,caffeic acid 2-phenylethyl ester PubChem CID: 5281787 ChEBI: CHEBI:8062 IUPAC Name: 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: OC1=CC=C(\C=C\C(=O)OCCC2=CC=CC=C2)C=C1O
| PubChem CID | 5281787 |
|---|---|
| CAS | 104594-70-9 |
| Molecular Weight (g/mol) | 284.31 |
| ChEBI | CHEBI:8062 |
| MDL Number | MFCD00866470 |
| SMILES | OC1=CC=C(\C=C\C(=O)OCCC2=CC=CC=C2)C=C1O |
| Synonym | caffeic acid phenethyl ester,phenethyl caffeate,cape,capeee,phenethyl 3-3,4-dihydroxyphenyl acrylate,phenylethyl caffeate,unii-g960r9s5sk,caffeic acid phenylethyl ester,2-phenylethyl caffeate,caffeic acid 2-phenylethyl ester |
| IUPAC Name | 2-phenylethyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate |
| InChI Key | SWUARLUWKZWEBQ-VQHVLOKHSA-N |
| Molecular Formula | C17H16O4 |
4-Ethylresorcinol, 98%
CAS: 2896-60-8 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002283 InChI Key: VGMJYYDKPUPTID-UHFFFAOYSA-N Synonym: 4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol PubChem CID: 17927 IUPAC Name: 4-ethylbenzene-1,3-diol SMILES: CCC1=C(C=C(C=C1)O)O
| PubChem CID | 17927 |
|---|---|
| CAS | 2896-60-8 |
| Molecular Weight (g/mol) | 138.166 |
| MDL Number | MFCD00002283 |
| SMILES | CCC1=C(C=C(C=C1)O)O |
| Synonym | 4-ethylresorcinol,1,3-benzenediol, 4-ethyl,6-ethylresorcinol,resorcinol, 4-ethyl,1,3-dihydroxy-4-ethylbenzene,4-ethyl resorcinol,2,4-dihydroxy-1-ethylbenzene,unii-8ye81t06d5,4-ethyl-benzene-1,3-diol,4-ethyl-resorcinol |
| IUPAC Name | 4-ethylbenzene-1,3-diol |
| InChI Key | VGMJYYDKPUPTID-UHFFFAOYSA-N |
| Molecular Formula | C8H10O2 |
2-Iodoresorcinol, 97%
CAS: 41046-67-7 Molecular Formula: C6H5IO2 Molecular Weight (g/mol): 236.008 MDL Number: MFCD09701440 InChI Key: BNJXHRMYHDWZKL-UHFFFAOYSA-N Synonym: 2-iodoresorcinol,2-iodo-1,3-benzenediol,1,3-benzenediol, 2-iodo,2-iodo-1,3-dihydroxybenzene,iodoresorcinol,ambkkkkk491,acmc-1aol8,1,3-benzenediol,2-iodo,2-iodo-benzene-1,3-diol,2-iodo-1,3-benzenediol # PubChem CID: 616833 IUPAC Name: 2-iodobenzene-1,3-diol SMILES: C1=CC(=C(C(=C1)O)I)O
| PubChem CID | 616833 |
|---|---|
| CAS | 41046-67-7 |
| Molecular Weight (g/mol) | 236.008 |
| MDL Number | MFCD09701440 |
| SMILES | C1=CC(=C(C(=C1)O)I)O |
| Synonym | 2-iodoresorcinol,2-iodo-1,3-benzenediol,1,3-benzenediol, 2-iodo,2-iodo-1,3-dihydroxybenzene,iodoresorcinol,ambkkkkk491,acmc-1aol8,1,3-benzenediol,2-iodo,2-iodo-benzene-1,3-diol,2-iodo-1,3-benzenediol # |
| IUPAC Name | 2-iodobenzene-1,3-diol |
| InChI Key | BNJXHRMYHDWZKL-UHFFFAOYSA-N |
| Molecular Formula | C6H5IO2 |
2-Nitroresorcinol, 98%
CAS: 601-89-8 Molecular Formula: C6H5NO4 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00007124 InChI Key: ZLCPKMIJYMHZMJ-UHFFFAOYSA-N Synonym: 2-nitroresorcinol,2-nitrobenzene-1,3-diol,1,3-benzenediol, 2-nitro,resorcinol, 2-nitro,2-nitro-1,3-benzenediol,1,3-dihydroxy-2-nitrobenzene,1,3-benzenediol, nitro,2,6-dihydroxynitrobenzene,nitroresorcinol,acmc-209mid PubChem CID: 11760 IUPAC Name: 2-nitrobenzene-1,3-diol SMILES: OC1=CC=CC(O)=C1[N+]([O-])=O
| PubChem CID | 11760 |
|---|---|
| CAS | 601-89-8 |
| Molecular Weight (g/mol) | 155.11 |
| MDL Number | MFCD00007124 |
| SMILES | OC1=CC=CC(O)=C1[N+]([O-])=O |
| Synonym | 2-nitroresorcinol,2-nitrobenzene-1,3-diol,1,3-benzenediol, 2-nitro,resorcinol, 2-nitro,2-nitro-1,3-benzenediol,1,3-dihydroxy-2-nitrobenzene,1,3-benzenediol, nitro,2,6-dihydroxynitrobenzene,nitroresorcinol,acmc-209mid |
| IUPAC Name | 2-nitrobenzene-1,3-diol |
| InChI Key | ZLCPKMIJYMHZMJ-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO4 |
Quinhydrone, MP Biomedicals™
CAS: 106-34-3 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00010310 InChI Key: BDJXVNRFAQSMAA-UHFFFAOYSA-N Synonym: quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1 PubChem CID: 7801 ChEBI: CHEBI:26491 IUPAC Name: benzene-1,4-diol; cyclohexa-2,5-diene-1,4-dione SMILES: OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1
| PubChem CID | 7801 |
|---|---|
| CAS | 106-34-3 |
| Molecular Weight (g/mol) | 218.21 |
| ChEBI | CHEBI:26491 |
| MDL Number | MFCD00010310 |
| SMILES | OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1 |
| Synonym | quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1 |
| IUPAC Name | benzene-1,4-diol; cyclohexa-2,5-diene-1,4-dione |
| InChI Key | BDJXVNRFAQSMAA-UHFFFAOYSA-N |
| Molecular Formula | C12H10O4 |
Epinephrine, USP, 97-100.5%, Spectrum™ Chemical
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CAS: 51-43-4 Molecular Formula: C9H13NO3 Molecular Weight (g/mol): 183.21 InChI Key: UCTWMZQNUQWSLP-VIFPVBQESA-N IUPAC Name: 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol SMILES: CNC[C@H](O)C1=CC=C(O)C(O)=C1
| CAS | 51-43-4 |
|---|---|
| Molecular Weight (g/mol) | 183.21 |
| SMILES | CNC[C@H](O)C1=CC=C(O)C(O)=C1 |
| IUPAC Name | 4-[(1R)-1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol |
| InChI Key | UCTWMZQNUQWSLP-VIFPVBQESA-N |
| Molecular Formula | C9H13NO3 |