| CAS Number | 36178-62-8 |
| Catalog Number | AG018N18(AGN-PC-02ZB9K) |
| Chemical Name | (Cyclopropylmethyl)(prop-2-en-1-yl)amine |
| IUPAC Name | N-(cyclopropylmethyl)prop-2-en-1-amine |
| InChI | InChI=1S/C7H13N/c1-2-5-8-6-7-3-4-7/h2,7-8H,1,3-6H2 |
| InChI Key | HCKGOMVEFZLDBU-UHFFFAOYSA-N |
| MDL Number | MFCD12138689 |
| Molecular Formula | C7H13N |
| Molecular Weight | 111.1848 |
| SMILES | C=CCNCC1CC1 |
| Synonyms | (cyclopropylmethyl)(prop-2-en-1-yl)amine,
36178-62-8,
SCHEMBL2712275,
CTK8E2759,
HCKGOMVEFZLDBU-UHFFFAOYSA-N,
ZINC37118232,
AKOS009591514,
NE50943,
N-(cyclopropylmethyl)prop-2-en-1-amine,
TX-015655,
FT-0753803,
F2158-1949,
Z1497165918,
N-2-propen-1-yl-Cyclopropanemethanamine,
|
| Complexity | 74.5 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 111.105g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 111.188g/mol |
| Monoisotopic Mass | 111.105g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number