| CAS Number | 1261921-15-6 |
| Catalog Number | AG00HLL6 |
| Chemical Name | 6-Chloro-2-(4-chlorophenyl)benzoic acid |
| IUPAC Name | 2-chloro-6-(4-chlorophenyl)benzoic acid |
| InChI | InChI=1S/C13H8Cl2O2/c14-9-6-4-8(5-7-9)10-2-1-3-11(15)12(10)13(16)17/h1-7H,(H,16,17) |
| InChI Key | NGVXQPKBYRCUDP-UHFFFAOYSA-N |
| MDL Number | MFCD18319934 |
| Molecular Formula | C13H8Cl2O2 |
| Molecular Weight | 267.1074 |
| SMILES | Clc1ccc(cc1)c1cccc(c1C(=O)O)Cl |
| Synonyms | 1261921-15-6,
6-CHLORO-2-(4-CHLOROPHENYL)BENZOIC ACID,
3,4'-Dichloro-[1,1'-biphenyl]-2-carboxylic acid,
DTXSID90689580,
MFCD18319934,
AKOS027433689,
K-2591,
3,4'-Dichloro[1,1'-biphenyl]-2-carboxylic acid,
2-chloro-6-(4-chlorophenyl)benzoic acid,
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| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.105g/mol |
| Monoisotopic Mass | 265.99g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^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