| CAS Number | 760157-03-7 |
| Catalog Number | AG01BF42 |
| Chemical Name | [1-(2,6-Dichlorophenyl)cyclobutyl]methanamine |
| IUPAC Name | [1-(2,6-dichlorophenyl)cyclobutyl]methanamine |
| InChI | InChI=1S/C11H13Cl2N/c12-8-3-1-4-9(13)10(8)11(7-14)5-2-6-11/h1,3-4H,2,5-7,14H2 |
| InChI Key | YYWKSMGFLAGUTC-UHFFFAOYSA-N |
| MDL Number | MFCD11188917 |
| Molecular Formula | C11H13Cl2N |
| Molecular Weight | 230.1336 |
| SMILES | NCC1(C2=C(Cl)C=CC=C2Cl)CCC1 |
| Synonyms | [1-(2,6-dichlorophenyl)cyclobutyl]methanamine,
760157-03-7,
1-(2,6-Dichlorophenyl)cyclobutanemethanamine,
ZINC20429484,
AKOS009264555,
NE36930,
SY164826,
MFCD11188917 (95%),
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.043g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.132g/mol |
| Monoisotopic Mass | 229.043g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number