| CAS Number | 13294-63-8 |
| Catalog Number | AG0011FM(AGN-PC-0WG452) |
| Chemical Name | 3-Chloro-1,1-diphenylpropan-2-one |
| IUPAC Name | 3-chloro-1,1-diphenylpropan-2-one |
| InChI | InChI=1S/C15H13ClO/c16-11-14(17)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2 |
| InChI Key | FDKZWKIFDIVPDI-UHFFFAOYSA-N |
| MDL Number | MFCD28991978 |
| Molecular Formula | C15H13ClO |
| Molecular Weight | 244.7161 |
| SMILES | ClCC(C(C1=CC=CC=C1)C1=CC=CC=C1)=O |
| Synonyms | 3-Chloro-1,1-diphenylpropan-2-one,
13294-63-8,
SCHEMBL19340059,
MFCD28991978,
ZINC261507086,
2-Propanone, 3-chloro-1,1-diphenyl-,
CS-0036871,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.718g/mol |
| Monoisotopic Mass | 244.065g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number