| CAS Number | 98278-54-7 |
| Catalog Number | AG018SCI(AGN-PC-0WBPWN) |
| Chemical Name | 2-(methylsulfanyl)cyclopentan-1-amine |
| IUPAC Name | 2-methylsulfanylcyclopentan-1-amine |
| InChI | InChI=1S/C6H13NS/c1-8-6-4-2-3-5(6)7/h5-6H,2-4,7H2,1H3 |
| InChI Key | LYDDFFMJUBFRAW-UHFFFAOYSA-N |
| MDL Number | MFCD19214737 |
| Molecular Formula | C6H13NS |
| Molecular Weight | 131.2391 |
| SMILES | CSC1C(N)CCC1 |
| Synonyms | 2-(methylsulfanyl)cyclopentan-1-amine,
98278-54-7,
2-(Methylthio)cyclopentan-1-amine,
AC1N879N,
SCHEMBL6952661,
2-methylsulfanylcyclopentan-1-amine,
AKOS006350333,
MCULE-2843614842,
NE54233,
EN300-91777,
F8889-8310,
Z1263811597,
NSC38956,
CID4314252,
|
| Complexity | 74.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.237g/mol |
| Monoisotopic Mass | 131.077g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number