| CAS Number | 1493200-84-2 |
| Catalog Number | AG01B5ET |
| Chemical Name | 2-{1-[(methylsulfanyl)methyl]cyclopropyl}ethan-1-amine |
| IUPAC Name | 2-[1-(methylsulfanylmethyl)cyclopropyl]ethanamine |
| InChI | InChI=1S/C7H15NS/c1-9-6-7(2-3-7)4-5-8/h2-6,8H2,1H3 |
| InChI Key | GHRCVPICYZCFOQ-UHFFFAOYSA-N |
| MDL Number | MFCD21245603 |
| Molecular Formula | C7H15NS |
| Molecular Weight | 145.2657 |
| SMILES | CSCC1(CC1)CCN |
| Synonyms | 2-{1-[(methylsulfanyl)methyl]cyclopropyl}ethan-1-amine,
1493200-84-2,
ZINC83854311,
AKOS014833344,
|
| Complexity | 88.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 145.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 145.264g/mol |
| Monoisotopic Mass | 145.093g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 51.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number