Phenols
TraceCERT™ Guaiacol, 2000 μg/mL, Certified Reference Material, MilliporeSigma™ Supelco™
This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.
4-Amino-2,6-dichlorophenol, 97%
CAS: 5930-28-9 Molecular Formula: C6H5Cl2NO Molecular Weight (g/mol): 178.01 MDL Number: MFCD00007875 InChI Key: KGEXISHTCZHGFT-UHFFFAOYSA-N Synonym: 2,6-dichloro-4-aminophenol,phenol, 4-amino-2,6-dichloro,2,6-dichloro-p-aminophenol,3,5-dichloro-4-hydroxyaniline,unii-i0l4csx5n0,i0l4csx5n0,2,6-dichloro-4-amino phenol,4-amino-2,6-dichloro-phenol,acmc-209mc4,dsstox_cid_20720 PubChem CID: 80037 IUPAC Name: 4-amino-2,6-dichlorophenol SMILES: NC1=CC(Cl)=C(O)C(Cl)=C1
| PubChem CID | 80037 |
|---|---|
| CAS | 5930-28-9 |
| Molecular Weight (g/mol) | 178.01 |
| MDL Number | MFCD00007875 |
| SMILES | NC1=CC(Cl)=C(O)C(Cl)=C1 |
| Synonym | 2,6-dichloro-4-aminophenol,phenol, 4-amino-2,6-dichloro,2,6-dichloro-p-aminophenol,3,5-dichloro-4-hydroxyaniline,unii-i0l4csx5n0,i0l4csx5n0,2,6-dichloro-4-amino phenol,4-amino-2,6-dichloro-phenol,acmc-209mc4,dsstox_cid_20720 |
| IUPAC Name | 4-amino-2,6-dichlorophenol |
| InChI Key | KGEXISHTCZHGFT-UHFFFAOYSA-N |
| Molecular Formula | C6H5Cl2NO |
2,4,6-Trichlorophenol, 98%
CAS: 88-06-2 Molecular Formula: C6H3Cl3O MDL Number: MFCD00002172 InChI Key: LINPIYWFGCPVIE-UHFFFAOYSA-N PubChem CID: 6914 ChEBI: CHEBI:28755 IUPAC Name: 2,4,6-trichlorophenol
| PubChem CID | 6914 |
|---|---|
| CAS | 88-06-2 |
| ChEBI | CHEBI:28755 |
| MDL Number | MFCD00002172 |
| IUPAC Name | 2,4,6-trichlorophenol |
| InChI Key | LINPIYWFGCPVIE-UHFFFAOYSA-N |
| Molecular Formula | C6H3Cl3O |
3,5-Dihydroxybenzoic acid, 97%
CAS: 99-10-5 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002512 InChI Key: UYEMGAFJOZZIFP-UHFFFAOYSA-N Synonym: alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid PubChem CID: 7424 ChEBI: CHEBI:39912 IUPAC Name: 3,5-dihydroxybenzoic acid SMILES: OC(=O)C1=CC(O)=CC(O)=C1
| PubChem CID | 7424 |
|---|---|
| CAS | 99-10-5 |
| Molecular Weight (g/mol) | 154.12 |
| ChEBI | CHEBI:39912 |
| MDL Number | MFCD00002512 |
| SMILES | OC(=O)C1=CC(O)=CC(O)=C1 |
| Synonym | alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid |
| IUPAC Name | 3,5-dihydroxybenzoic acid |
| InChI Key | UYEMGAFJOZZIFP-UHFFFAOYSA-N |
| Molecular Formula | C7H6O4 |
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 |
2-Bromo-5-(trifluoromethoxy)phenol, 97%
CAS: 205371-26-2 Molecular Formula: C7H4BrF3O2 Molecular Weight (g/mol): 257.01 MDL Number: MFCD06660162 InChI Key: RHRRKORKKIVAGJ-UHFFFAOYSA-N Synonym: 2-bromo-5-trifluoromethoxy phenol,phenol, 2-bromo-5-trifluoromethoxy,2-hydroxy-4-trifluoromethoxy bromobenzene,1-bromo-2-hydroxy-4-trifluoromethoxy benzene,pubchem15610,acmc-209fbt,rhrrkorkkivagj-uhfffaoysa,phenol,2-bromo-5-trifluoromethoxy,2-bromanyl-5-trifluoromethyloxy phenol PubChem CID: 17750742 IUPAC Name: 2-bromo-5-(trifluoromethoxy)phenol SMILES: OC1=C(Br)C=CC(OC(F)(F)F)=C1
| PubChem CID | 17750742 |
|---|---|
| CAS | 205371-26-2 |
| Molecular Weight (g/mol) | 257.01 |
| MDL Number | MFCD06660162 |
| SMILES | OC1=C(Br)C=CC(OC(F)(F)F)=C1 |
| Synonym | 2-bromo-5-trifluoromethoxy phenol,phenol, 2-bromo-5-trifluoromethoxy,2-hydroxy-4-trifluoromethoxy bromobenzene,1-bromo-2-hydroxy-4-trifluoromethoxy benzene,pubchem15610,acmc-209fbt,rhrrkorkkivagj-uhfffaoysa,phenol,2-bromo-5-trifluoromethoxy,2-bromanyl-5-trifluoromethyloxy phenol |
| IUPAC Name | 2-bromo-5-(trifluoromethoxy)phenol |
| InChI Key | RHRRKORKKIVAGJ-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrF3O2 |
3-Chloro-4-methylphenol, 97%, Thermo Scientific Chemicals
CAS: 615-62-3 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.58 MDL Number: MFCD00060319 InChI Key: VQZRLBWPEHFGCD-UHFFFAOYSA-N Synonym: phenol, 3-chloro-4-methyl,3-chloro-p-cresol,p-cresol, 3-chloro,3-chloro-4-methyl-phenol,acmc-20aibl,pubchem3671,2-chloro-4-hydroxytoluene,phenol,3-chloro-4-methyl,p-cresol, 3-chloro-8ci,3-chloro-4-methylphenol PubChem CID: 14853 IUPAC Name: 3-chloro-4-methylphenol SMILES: CC1=CC=C(O)C=C1Cl
| PubChem CID | 14853 |
|---|---|
| CAS | 615-62-3 |
| Molecular Weight (g/mol) | 142.58 |
| MDL Number | MFCD00060319 |
| SMILES | CC1=CC=C(O)C=C1Cl |
| Synonym | phenol, 3-chloro-4-methyl,3-chloro-p-cresol,p-cresol, 3-chloro,3-chloro-4-methyl-phenol,acmc-20aibl,pubchem3671,2-chloro-4-hydroxytoluene,phenol,3-chloro-4-methyl,p-cresol, 3-chloro-8ci,3-chloro-4-methylphenol |
| IUPAC Name | 3-chloro-4-methylphenol |
| InChI Key | VQZRLBWPEHFGCD-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO |
2,6-Difluoro-4-iodophenol, 99%
CAS: 950858-06-7 Molecular Formula: C6H3F2IO Molecular Weight (g/mol): 255.99 MDL Number: MFCD09907951 InChI Key: LHUADYKKTXZZMQ-UHFFFAOYSA-N PubChem CID: 45790937 IUPAC Name: 2,6-difluoro-4-iodophenol SMILES: C1=C(C=C(C(=C1F)O)F)I
| PubChem CID | 45790937 |
|---|---|
| CAS | 950858-06-7 |
| Molecular Weight (g/mol) | 255.99 |
| MDL Number | MFCD09907951 |
| SMILES | C1=C(C=C(C(=C1F)O)F)I |
| IUPAC Name | 2,6-difluoro-4-iodophenol |
| InChI Key | LHUADYKKTXZZMQ-UHFFFAOYSA-N |
| Molecular Formula | C6H3F2IO |
2,4-Difluoro-5-nitrophenol, 98%
CAS: 113512-57-5 Molecular Formula: C6H3F2NO3 Molecular Weight (g/mol): 175.091 MDL Number: MFCD08443942 InChI Key: SMRYCTJAGPDVEH-UHFFFAOYSA-N Synonym: 2,4-difluoro-5-nitrobenzenol,phenol, 2,4-difluoro-5-nitro,difluoronitrobenzenol,acmc-209wyr,2,4-difluoro-5-hydroxynitrobenzene PubChem CID: 10921024 IUPAC Name: 2,4-difluoro-5-nitrophenol SMILES: C1=C(C(=CC(=C1O)F)F)[N+](=O)[O-]
| PubChem CID | 10921024 |
|---|---|
| CAS | 113512-57-5 |
| Molecular Weight (g/mol) | 175.091 |
| MDL Number | MFCD08443942 |
| SMILES | C1=C(C(=CC(=C1O)F)F)[N+](=O)[O-] |
| Synonym | 2,4-difluoro-5-nitrobenzenol,phenol, 2,4-difluoro-5-nitro,difluoronitrobenzenol,acmc-209wyr,2,4-difluoro-5-hydroxynitrobenzene |
| IUPAC Name | 2,4-difluoro-5-nitrophenol |
| InChI Key | SMRYCTJAGPDVEH-UHFFFAOYSA-N |
| Molecular Formula | C6H3F2NO3 |
2-Methylbenzothiazol-5-ol, 97%
CAS: 68867-14-1 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00192276 InChI Key: LAKVUPMDDFICNR-UHFFFAOYSA-N PubChem CID: 699799 IUPAC Name: 2-methyl-1,3-benzothiazol-5-ol SMILES: CC1=NC2=CC(O)=CC=C2S1
| PubChem CID | 699799 |
|---|---|
| CAS | 68867-14-1 |
| Molecular Weight (g/mol) | 165.21 |
| MDL Number | MFCD00192276 |
| SMILES | CC1=NC2=CC(O)=CC=C2S1 |
| IUPAC Name | 2-methyl-1,3-benzothiazol-5-ol |
| InChI Key | LAKVUPMDDFICNR-UHFFFAOYSA-N |
| Molecular Formula | C8H7NOS |
p-Cresol, 99%
CAS: 106-44-5 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00002376 InChI Key: IWDCLRJOBJJRNH-UHFFFAOYSA-N Synonym: p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene PubChem CID: 2879 ChEBI: CHEBI:17847 IUPAC Name: 4-methylphenol SMILES: CC1=CC=C(C=C1)O
| PubChem CID | 2879 |
|---|---|
| CAS | 106-44-5 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17847 |
| MDL Number | MFCD00002376 |
| SMILES | CC1=CC=C(C=C1)O |
| Synonym | p-cresol,4-cresol,4-hydroxytoluene,p-methylphenol,phenol, 4-methyl,p-hydroxytoluene,p-tolyl alcohol,p-kresol,para-cresol,p-oxytoluene |
| IUPAC Name | 4-methylphenol |
| InChI Key | IWDCLRJOBJJRNH-UHFFFAOYSA-N |
| Molecular Formula | C7H8O |
4-(4-Hydroxyphenyl)-2-butanone, 98%
CAS: 5471-51-2 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002394 InChI Key: NJGBTKGETPDVIK-UHFFFAOYSA-N Synonym: 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone PubChem CID: 21648 ChEBI: CHEBI:68656 IUPAC Name: 4-(4-hydroxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC=C(C=C1)O
| PubChem CID | 21648 |
|---|---|
| CAS | 5471-51-2 |
| Molecular Weight (g/mol) | 164.204 |
| ChEBI | CHEBI:68656 |
| MDL Number | MFCD00002394 |
| SMILES | CC(=O)CCC1=CC=C(C=C1)O |
| Synonym | 4-4-hydroxyphenyl-2-butanone,raspberry ketone,4-4-hydroxyphenyl butan-2-one,frambinone,oxyphenalon,rheosmin,4-p-hydroxyphenyl-2-butanone,4-hydroxybenzylacetone,betuligenol,rasketone |
| IUPAC Name | 4-(4-hydroxyphenyl)butan-2-one |
| InChI Key | NJGBTKGETPDVIK-UHFFFAOYSA-N |
| Molecular Formula | C10H12O2 |
5-Bromo-2-fluorophenol, 98%
CAS: 112204-58-7 Molecular Formula: C6H4BrFO Molecular Weight (g/mol): 190.999 MDL Number: MFCD07782066 InChI Key: YPTHSYKJDRMAJY-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromophenol,phenol, 5-bromo-2-fluoro,2-fluoro-5-bromo phenol,5-bromo-2-fluoro-phenol,3-bromo-6-fluorophenol,3-bromo-6-fluoro-phenol,acmc-2099dd,ksc493i2d PubChem CID: 183421 IUPAC Name: 5-bromo-2-fluorophenol SMILES: C1=CC(=C(C=C1Br)O)F
| PubChem CID | 183421 |
|---|---|
| CAS | 112204-58-7 |
| Molecular Weight (g/mol) | 190.999 |
| MDL Number | MFCD07782066 |
| SMILES | C1=CC(=C(C=C1Br)O)F |
| Synonym | 2-fluoro-5-bromophenol,phenol, 5-bromo-2-fluoro,2-fluoro-5-bromo phenol,5-bromo-2-fluoro-phenol,3-bromo-6-fluorophenol,3-bromo-6-fluoro-phenol,acmc-2099dd,ksc493i2d |
| IUPAC Name | 5-bromo-2-fluorophenol |
| InChI Key | YPTHSYKJDRMAJY-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrFO |
3-Fluoro-2-nitrophenol, 97%
CAS: 385-01-3 Molecular Formula: C6H4FNO3 Molecular Weight (g/mol): 157.1 MDL Number: MFCD07368753 InChI Key: GAWNBKUTBVLIPL-UHFFFAOYSA-N Synonym: 3-fluoro-2-nitro-phenol,2-nitro-3-fluorophenol,phenol, 3-fluoro-2-nitro,3-fluoronitro-phenol,pubchem4124,acmc-209j0i,ksc497m1h PubChem CID: 2782777 IUPAC Name: 3-fluoro-2-nitrophenol SMILES: C1=CC(=C(C(=C1)F)[N+](=O)[O-])O
| PubChem CID | 2782777 |
|---|---|
| CAS | 385-01-3 |
| Molecular Weight (g/mol) | 157.1 |
| MDL Number | MFCD07368753 |
| SMILES | C1=CC(=C(C(=C1)F)[N+](=O)[O-])O |
| Synonym | 3-fluoro-2-nitro-phenol,2-nitro-3-fluorophenol,phenol, 3-fluoro-2-nitro,3-fluoronitro-phenol,pubchem4124,acmc-209j0i,ksc497m1h |
| IUPAC Name | 3-fluoro-2-nitrophenol |
| InChI Key | GAWNBKUTBVLIPL-UHFFFAOYSA-N |
| Molecular Formula | C6H4FNO3 |
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 |