| CAS Number | 191724-14-8 |
| Catalog Number | AG00I2UG(AGN-PC-09Q0L1) |
| Chemical Name | 4-(3-Chloro-4-methylphenyl)phenol |
| IUPAC Name | 4-(3-chloro-4-methylphenyl)phenol |
| InChI | InChI=1S/C13H11ClO/c1-9-2-3-11(8-13(9)14)10-4-6-12(15)7-5-10/h2-8,15H,1H3 |
| InChI Key | ZWSYNGNKSHPQNU-UHFFFAOYSA-N |
| MDL Number | MFCD00509341 |
| Molecular Formula | C13H11ClO |
| Molecular Weight | 218.6788 |
| SMILES | C1(=CC=C(C(Cl)=C1)C)C1C=CC(O)=CC=1 |
| Synonyms | 191724-14-8,
4-(3-CHLORO-4-METHYLPHENYL)PHENOL,
3-CHLORO-4'-HYDROXY-4-METHYLBIPHENYL,
3'-Chloro-4'-methyl-[1,1'-biphenyl]-4-ol,
DTXSID50683509,
MFCD00509341,
ZINC13840604,
AKOS017547913,
3'-Chloro-4'-methyl[1,1'-biphenyl]-4-ol,
K-5707,
[1,1'-Biphenyl]-4-ol, 3'-chloro-4'-methyl-,
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| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.68g/mol |
| Monoisotopic Mass | 218.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number