Phenols
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3,5-Difluoro-4-hydroxybenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals
CAS: 1029439-83-5 Molecular Formula: C12H15BF2O3 Molecular Weight (g/mol): 256.056 MDL Number: MFCD16996286 InChI Key: KTQYJNVSVKKLGQ-UHFFFAOYSA-N Synonym: 2,6-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,3,5-difluoro-4-hydroxybenzeneboronic acid pinacol ester,3,5-difluoro-4-hydroxyphenylboronic acid pinacol ester PubChem CID: 57655406 IUPAC Name: 2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)F)O)F
| PubChem CID | 57655406 |
|---|---|
| CAS | 1029439-83-5 |
| Molecular Weight (g/mol) | 256.056 |
| MDL Number | MFCD16996286 |
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)F)O)F |
| Synonym | 2,6-difluoro-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenol,3,5-difluoro-4-hydroxybenzeneboronic acid pinacol ester,3,5-difluoro-4-hydroxyphenylboronic acid pinacol ester |
| IUPAC Name | 2,6-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol |
| InChI Key | KTQYJNVSVKKLGQ-UHFFFAOYSA-N |
| Molecular Formula | C12H15BF2O3 |
2-Hydroxybenzonitrile, 98%
CAS: 611-20-1 Molecular Formula: C7H5NO Molecular Weight (g/mol): 119.123 MDL Number: MFCD00002145 InChI Key: CHZCERSEMVWNHL-UHFFFAOYSA-N Synonym: 2-cyanophenol,o-cyanophenol,salicylonitrile,o-hydroxybenzonitrile,benzonitrile, 2-hydroxy,salicylnitrile,benzonitrile, hydroxy,benzonitrile, o-hydroxy,o-hydoxybenzonitrile,2-hydroxy-benzonitrile PubChem CID: 11907 IUPAC Name: 2-hydroxybenzonitrile SMILES: C1=CC=C(C(=C1)C#N)O
| PubChem CID | 11907 |
|---|---|
| CAS | 611-20-1 |
| Molecular Weight (g/mol) | 119.123 |
| MDL Number | MFCD00002145 |
| SMILES | C1=CC=C(C(=C1)C#N)O |
| Synonym | 2-cyanophenol,o-cyanophenol,salicylonitrile,o-hydroxybenzonitrile,benzonitrile, 2-hydroxy,salicylnitrile,benzonitrile, hydroxy,benzonitrile, o-hydroxy,o-hydoxybenzonitrile,2-hydroxy-benzonitrile |
| IUPAC Name | 2-hydroxybenzonitrile |
| InChI Key | CHZCERSEMVWNHL-UHFFFAOYSA-N |
| Molecular Formula | C7H5NO |
4-Bromo-2,3-difluorophenol, 97%, Thermo Scientific Chemicals
CAS: 144292-32-0 Molecular Formula: C6H3BrF2O Molecular Weight (g/mol): 208.99 MDL Number: MFCD08061907 InChI Key: JZAVCMMYGSROJP-UHFFFAOYSA-N Synonym: 2,3-difluoro-4-bromophenol,4-bromo-2,3-difluoro-phenol,phenol, 4-bromo-2,3-difluoro,pubchem2477,pubchem4111,acmc-209csf,bromodifluorophenol,ksc494o1n,2,3-difluoro 4-bromo phenol,2.3-difluoro-4-bromo phenol PubChem CID: 10219942 IUPAC Name: 4-bromo-2,3-difluorophenol SMILES: OC1=C(F)C(F)=C(Br)C=C1
| PubChem CID | 10219942 |
|---|---|
| CAS | 144292-32-0 |
| Molecular Weight (g/mol) | 208.99 |
| MDL Number | MFCD08061907 |
| SMILES | OC1=C(F)C(F)=C(Br)C=C1 |
| Synonym | 2,3-difluoro-4-bromophenol,4-bromo-2,3-difluoro-phenol,phenol, 4-bromo-2,3-difluoro,pubchem2477,pubchem4111,acmc-209csf,bromodifluorophenol,ksc494o1n,2,3-difluoro 4-bromo phenol,2.3-difluoro-4-bromo phenol |
| IUPAC Name | 4-bromo-2,3-difluorophenol |
| InChI Key | JZAVCMMYGSROJP-UHFFFAOYSA-N |
| Molecular Formula | C6H3BrF2O |
Chloroxylenol, USP, 98.5%, Spectrum™ Chemical
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CAS: 88-04-0 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 InChI Key: OSDLLIBGSJNGJE-UHFFFAOYSA-N IUPAC Name: 4-chloro-3,5-dimethylphenol SMILES: CC1=CC(O)=CC(C)=C1Cl
| CAS | 88-04-0 |
|---|---|
| Molecular Weight (g/mol) | 156.61 |
| SMILES | CC1=CC(O)=CC(C)=C1Cl |
| IUPAC Name | 4-chloro-3,5-dimethylphenol |
| InChI Key | OSDLLIBGSJNGJE-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
3-Methylcatechol, 97%
CAS: 488-17-5 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD00016435 InChI Key: PGSWEKYNAOWQDF-UHFFFAOYSA-N Synonym: 3-methylcatechol,2,3-dihydroxytoluene,3-methylpyrocatechol,1,2-benzenediol, 3-methyl,2,3-toluenediol,dihydroxytoluene,pyrocatechol, 3-methyl,catechol, 3-methyl,1,2-dihydroxy-3-methylbenzene,3-methyl-1,2-benzenediol PubChem CID: 340 ChEBI: CHEBI:18404 IUPAC Name: 3-methylbenzene-1,2-diol SMILES: CC1=C(C(=CC=C1)O)O
| PubChem CID | 340 |
|---|---|
| CAS | 488-17-5 |
| Molecular Weight (g/mol) | 124.139 |
| ChEBI | CHEBI:18404 |
| MDL Number | MFCD00016435 |
| SMILES | CC1=C(C(=CC=C1)O)O |
| Synonym | 3-methylcatechol,2,3-dihydroxytoluene,3-methylpyrocatechol,1,2-benzenediol, 3-methyl,2,3-toluenediol,dihydroxytoluene,pyrocatechol, 3-methyl,catechol, 3-methyl,1,2-dihydroxy-3-methylbenzene,3-methyl-1,2-benzenediol |
| IUPAC Name | 3-methylbenzene-1,2-diol |
| InChI Key | PGSWEKYNAOWQDF-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
4,6-Diaminoresorcinol dihydrochloride, 98%
CAS: 16523-31-2 Molecular Formula: C6H8N2O2·2HCl Molecular Weight (g/mol): 213.06 MDL Number: MFCD00143239 InChI Key: KUMOYHHELWKOCB-UHFFFAOYSA-N Synonym: 4,6-diaminoresorcinol dihydrochloride,4,6-diaminobenzene-1,3-diol dihydrochloride,4,6-diaminoresorcinol 2hcl,1,3-benzenediol, 4,6-diamino-, dihydrochloride,4,6-diamino resorcinol dihydrochloride,4,6-diamino-benzene-1,3-diol 2hcl salt,1,3-benzenediol, 4,6-diamino-, hydrochloride 1:2,4,6-bis azanyl benzene-1,3-diol dihydrochloride,pubchem20873,acmc-1c78d PubChem CID: 2733648 IUPAC Name: 4,6-diaminobenzene-1,3-diol;dihydrochloride SMILES: C1=C(C(=CC(=C1N)O)O)N.Cl.Cl
| PubChem CID | 2733648 |
|---|---|
| CAS | 16523-31-2 |
| Molecular Weight (g/mol) | 213.06 |
| MDL Number | MFCD00143239 |
| SMILES | C1=C(C(=CC(=C1N)O)O)N.Cl.Cl |
| Synonym | 4,6-diaminoresorcinol dihydrochloride,4,6-diaminobenzene-1,3-diol dihydrochloride,4,6-diaminoresorcinol 2hcl,1,3-benzenediol, 4,6-diamino-, dihydrochloride,4,6-diamino resorcinol dihydrochloride,4,6-diamino-benzene-1,3-diol 2hcl salt,1,3-benzenediol, 4,6-diamino-, hydrochloride 1:2,4,6-bis azanyl benzene-1,3-diol dihydrochloride,pubchem20873,acmc-1c78d |
| IUPAC Name | 4,6-diaminobenzene-1,3-diol;dihydrochloride |
| InChI Key | KUMOYHHELWKOCB-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O2·2HCl |
5-Methyl-2-nitrophenol, 97%
CAS: 700-38-9 Molecular Formula: C7H7NO3 Molecular Weight (g/mol): 153.14 MDL Number: MFCD00007111 InChI Key: NQXUSSVLFOBRSE-UHFFFAOYSA-N Synonym: 6-nitro-m-cresol,phenol, 5-methyl-2-nitro,3-hydroxy-4-nitrotoluene,6-nitro-3-cresol,3-methyl-6-nitrophenol,m-cresol, 6-nitro,5-methyl-2-nitro-phenol,unii-z0b5eo9752,6-nitro-m-creso PubChem CID: 12788 IUPAC Name: 5-methyl-2-nitrophenol SMILES: CC1=CC=C(C(O)=C1)[N+]([O-])=O
| PubChem CID | 12788 |
|---|---|
| CAS | 700-38-9 |
| Molecular Weight (g/mol) | 153.14 |
| MDL Number | MFCD00007111 |
| SMILES | CC1=CC=C(C(O)=C1)[N+]([O-])=O |
| Synonym | 6-nitro-m-cresol,phenol, 5-methyl-2-nitro,3-hydroxy-4-nitrotoluene,6-nitro-3-cresol,3-methyl-6-nitrophenol,m-cresol, 6-nitro,5-methyl-2-nitro-phenol,unii-z0b5eo9752,6-nitro-m-creso |
| IUPAC Name | 5-methyl-2-nitrophenol |
| InChI Key | NQXUSSVLFOBRSE-UHFFFAOYSA-N |
| Molecular Formula | C7H7NO3 |
4-Bromo-2-(trifluoromethoxy)phenol, 98%, Thermo Scientific Chemicals
CAS: 690264-39-2 Molecular Formula: C7H4BrF3O2 Molecular Weight (g/mol): 257.01 MDL Number: MFCD09037798 InChI Key: GYXNTPVMXGBRQW-UHFFFAOYSA-N Synonym: 4-bromo-2-trifluoromethoxy phenol,4-bromo-2-trifluoromethoxy-phenol,4-bromanyl-2-trifluoromethyloxy phenol,phenol, 4-bromo-2-trifluoromethoxy PubChem CID: 11780151 IUPAC Name: 4-bromo-2-(trifluoromethoxy)phenol SMILES: OC1=C(OC(F)(F)F)C=C(Br)C=C1
| PubChem CID | 11780151 |
|---|---|
| CAS | 690264-39-2 |
| Molecular Weight (g/mol) | 257.01 |
| MDL Number | MFCD09037798 |
| SMILES | OC1=C(OC(F)(F)F)C=C(Br)C=C1 |
| Synonym | 4-bromo-2-trifluoromethoxy phenol,4-bromo-2-trifluoromethoxy-phenol,4-bromanyl-2-trifluoromethyloxy phenol,phenol, 4-bromo-2-trifluoromethoxy |
| IUPAC Name | 4-bromo-2-(trifluoromethoxy)phenol |
| InChI Key | GYXNTPVMXGBRQW-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3O2 |
Rosmarinic Acid, 98.6%, MP Biomedicals™
CAS: 20283-92-5 Molecular Formula: C18H16O8 Molecular Weight (g/mol): 360.318 MDL Number: MFCD00017740 InChI Key: DOUMFZQKYFQNTF-WUTVXBCWSA-N Synonym: rosmarinic acid,rosemary acid,r-rosmarinic acid,unii-mqe6xg29yi,rosmarinate,mqe6xg29yi,labiatenic acid,r-o-3,4-dihydroxycinnamoyl-3-3,4-dihydroxyphenyl lactic acid,3,4-dihydroxycinnamic acid r-1-carboxy-2-3,4-dihydroxyphenyl ethyl ester,2r-3-3,4-dihydroxyphenyl-2-2e-3-3,4-dihydroxyphenyl prop-2-enoyloxy propanoic acid PubChem CID: 5281792 ChEBI: CHEBI:50371 IUPAC Name: (2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid SMILES: C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
| PubChem CID | 5281792 |
|---|---|
| CAS | 20283-92-5 |
| Molecular Weight (g/mol) | 360.318 |
| ChEBI | CHEBI:50371 |
| MDL Number | MFCD00017740 |
| SMILES | C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O |
| Synonym | rosmarinic acid,rosemary acid,r-rosmarinic acid,unii-mqe6xg29yi,rosmarinate,mqe6xg29yi,labiatenic acid,r-o-3,4-dihydroxycinnamoyl-3-3,4-dihydroxyphenyl lactic acid,3,4-dihydroxycinnamic acid r-1-carboxy-2-3,4-dihydroxyphenyl ethyl ester,2r-3-3,4-dihydroxyphenyl-2-2e-3-3,4-dihydroxyphenyl prop-2-enoyloxy propanoic acid |
| IUPAC Name | (2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid |
| InChI Key | DOUMFZQKYFQNTF-WUTVXBCWSA-N |
| Molecular Formula | C18H16O8 |
4-Bromo-2-chloro-6-methylphenol, 97%, Thermo Scientific™
CAS: 7530-27-0 Molecular Formula: C7H6BrClO Molecular Weight (g/mol): 221.48 MDL Number: MFCD00002167 InChI Key: IDDUDPYBPXKGCP-UHFFFAOYSA-N PubChem CID: 82031 IUPAC Name: 4-bromo-2-chloro-6-methylphenol SMILES: CC1=CC(Br)=CC(Cl)=C1O
| PubChem CID | 82031 |
|---|---|
| CAS | 7530-27-0 |
| Molecular Weight (g/mol) | 221.48 |
| MDL Number | MFCD00002167 |
| SMILES | CC1=CC(Br)=CC(Cl)=C1O |
| IUPAC Name | 4-bromo-2-chloro-6-methylphenol |
| InChI Key | IDDUDPYBPXKGCP-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrClO |
2-Methylresorcinol, 98%
CAS: 608-25-3 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.14 MDL Number: MFCD00002271 InChI Key: ZTMADXFOCUXMJE-UHFFFAOYSA-N Synonym: 2-methylresorcinol,2,6-dihydroxytoluene,1,3-benzenediol, 2-methyl,2-methylresorcin,resorcinol, 2-methyl,toluene-2,6-diol,2-methyl-1,3-benzenediol,1,3-dihydroxy-2-methylbenzene,1,3-benzenediol, methyl,2-methyl resorcinol PubChem CID: 11843 IUPAC Name: 2-methylbenzene-1,3-diol SMILES: CC1=C(C=CC=C1O)O
| PubChem CID | 11843 |
|---|---|
| CAS | 608-25-3 |
| Molecular Weight (g/mol) | 124.14 |
| MDL Number | MFCD00002271 |
| SMILES | CC1=C(C=CC=C1O)O |
| Synonym | 2-methylresorcinol,2,6-dihydroxytoluene,1,3-benzenediol, 2-methyl,2-methylresorcin,resorcinol, 2-methyl,toluene-2,6-diol,2-methyl-1,3-benzenediol,1,3-dihydroxy-2-methylbenzene,1,3-benzenediol, methyl,2-methyl resorcinol |
| IUPAC Name | 2-methylbenzene-1,3-diol |
| InChI Key | ZTMADXFOCUXMJE-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2 |
3,5-Dinitrosalicylic acid, 97+%
CAS: 609-99-4 Molecular Formula: C7H4N2O7 Molecular Weight (g/mol): 228.116 MDL Number: MFCD00007104 InChI Key: LWFUFLREGJMOIZ-UHFFFAOYSA-N Synonym: 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid PubChem CID: 11873 ChEBI: CHEBI:53648 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]
| PubChem CID | 11873 |
|---|---|
| CAS | 609-99-4 |
| Molecular Weight (g/mol) | 228.116 |
| ChEBI | CHEBI:53648 |
| MDL Number | MFCD00007104 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-] |
| Synonym | 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid |
| InChI Key | LWFUFLREGJMOIZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2O7 |
4-Chloro-3-iodophenol, 98%
CAS: 202982-72-7 Molecular Formula: C6H4ClIO Molecular Weight (g/mol): 254.451 MDL Number: MFCD00070769 InChI Key: UPIATGHEVZKVRT-UHFFFAOYSA-N Synonym: phenol, 4-chloro-3-iodo,acmc-20adn2,4-chloro-3-iodo-phenol,phenol,4-chloro-3-iodo,4-chloro-3-iodophenol PubChem CID: 22928729 IUPAC Name: 4-chloro-3-iodophenol SMILES: C1=CC(=C(C=C1O)I)Cl
| PubChem CID | 22928729 |
|---|---|
| CAS | 202982-72-7 |
| Molecular Weight (g/mol) | 254.451 |
| MDL Number | MFCD00070769 |
| SMILES | C1=CC(=C(C=C1O)I)Cl |
| Synonym | phenol, 4-chloro-3-iodo,acmc-20adn2,4-chloro-3-iodo-phenol,phenol,4-chloro-3-iodo,4-chloro-3-iodophenol |
| IUPAC Name | 4-chloro-3-iodophenol |
| InChI Key | UPIATGHEVZKVRT-UHFFFAOYSA-N |
| Molecular Formula | C6H4ClIO |
2-Hydroxyphenylboronic acid, 97%
CAS: 89466-08-0 Molecular Formula: C6H7BO3 Molecular Weight (g/mol): 137.93 MDL Number: MFCD01074581 InChI Key: YDMRDHQUQIVWBE-UHFFFAOYSA-N Synonym: 2-hydroxyphenyl boronic acid,2-hydroxybenzeneboronic acid,o-hydroxyphenylboronic acid,2-boronophenol,2-hydroxyphenyl boranediol,2-hydroxyphenylboronicacid,boronic acid, 2-hydroxyphenyl,pubchem9522,2-hydroxyphenylboronic,acmc-209r1d PubChem CID: 2773454 IUPAC Name: (2-hydroxyphenyl)boronic acid SMILES: OB(O)C1=CC=CC=C1O
| PubChem CID | 2773454 |
|---|---|
| CAS | 89466-08-0 |
| Molecular Weight (g/mol) | 137.93 |
| MDL Number | MFCD01074581 |
| SMILES | OB(O)C1=CC=CC=C1O |
| Synonym | 2-hydroxyphenyl boronic acid,2-hydroxybenzeneboronic acid,o-hydroxyphenylboronic acid,2-boronophenol,2-hydroxyphenyl boranediol,2-hydroxyphenylboronicacid,boronic acid, 2-hydroxyphenyl,pubchem9522,2-hydroxyphenylboronic,acmc-209r1d |
| IUPAC Name | (2-hydroxyphenyl)boronic acid |
| InChI Key | YDMRDHQUQIVWBE-UHFFFAOYSA-N |
| Molecular Formula | C6H7BO3 |
o-Cresol, 99%, AcroSeal™
CAS: 95-48-7 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002226 InChI Key: QWVGKYWNOKOFNN-UHFFFAOYSA-N Synonym: o-cresol,2-hydroxytoluene,o-methylphenol,2-cresol,phenol, 2-methyl,orthocresol,o-cresylic acid,o-oxytoluene,o-toluol,o-hydroxytoluene PubChem CID: 335 ChEBI: CHEBI:28054 IUPAC Name: 2-methylphenol SMILES: CC1=CC=CC=C1O
| PubChem CID | 335 |
|---|---|
| CAS | 95-48-7 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:28054 |
| MDL Number | MFCD00002226 |
| SMILES | CC1=CC=CC=C1O |
| Synonym | o-cresol,2-hydroxytoluene,o-methylphenol,2-cresol,phenol, 2-methyl,orthocresol,o-cresylic acid,o-oxytoluene,o-toluol,o-hydroxytoluene |
| IUPAC Name | 2-methylphenol |
| InChI Key | QWVGKYWNOKOFNN-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |