| CAS Number | 923146-35-4 |
| Catalog Number | AG019PC8 |
| Chemical Name | 2-chloro-N-[2-methyl-4-(pyrrolidin-1-yl)phenyl]acetamide |
| IUPAC Name | 2-chloro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)acetamide |
| InChI | InChI=1S/C13H17ClN2O/c1-10-8-11(16-6-2-3-7-16)4-5-12(10)15-13(17)9-14/h4-5,8H,2-3,6-7,9H2,1H3,(H,15,17) |
| InChI Key | RSFAHYRQPFWIOA-UHFFFAOYSA-N |
| MDL Number | MFCD08691096 |
| Molecular Formula | C13H17ClN2O |
| Molecular Weight | 252.7399 |
| SMILES | CC1=C(NC(CCl)=O)C=CC(N2CCCC2)=C1 |
| Synonyms | 2-chloro-N-[2-methyl-4-(pyrrolidin-1-yl)phenyl]acetamide,
2-chloro-N-(2-methyl-4-pyrrolidin-1-ylphenyl)acetamide,
923146-35-4,
AC1Q2FT5,
CTK6H5538,
ZINC10037793,
AKOS009075677,
MCULE-5223991655,
NE43997,
UPCMLD0ENAT5662377:001,
EN300-23176,
|
| Complexity | 266 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.103g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.742g/mol |
| Monoisotopic Mass | 252.103g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number