| CAS Number | 103038-66-0 |
| Catalog Number | AG008V43(AGN-PC-0OS34K) |
| Chemical Name | 3-chloro-N-[(2-chlorophenyl)methyl]propanamide |
| IUPAC Name | 3-chloro-N-[(2-chlorophenyl)methyl]propanamide |
| InChI | InChI=1S/C10H11Cl2NO/c11-6-5-10(14)13-7-8-3-1-2-4-9(8)12/h1-4H,5-7H2,(H,13,14) |
| InChI Key | UDCPSNFIOXHTMT-UHFFFAOYSA-N |
| MDL Number | MFCD08569859 |
| Molecular Formula | C10H11Cl2NO |
| Molecular Weight | 232.1064 |
| SMILES | ClCCC(NCC1=C(Cl)C=CC=C1)=O |
| Synonyms | 3-chloro-N-(2-chlorobenzyl)propanamide,
103038-66-0,
3-chloro-N-[(2-chlorophenyl)methyl]propanamide,
Propanamide,3-chloro-N-[(2-chlorophenyl)methyl]-,
AC1Q3UGT,
ACMC-1C7PZ,
CTK4A1687,
DTXSID30589297,
MFCD08569859,
STK481854,
ZINC12505118,
AKOS000198919,
MCULE-4773963426,
AJ-62488,
RT-008686,
ST50942774,
EN300-25830,
Y-3952,
Z235348061,
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| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.104g/mol |
| Monoisotopic Mass | 231.022g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number