| CAS Number | 1159878-06-4 |
| Catalog Number | AG000HDY(AGN-PC-0WCKT8) |
| Chemical Name | 1-(Pyrimidin-2-Yl)Cyclopropanamine |
| IUPAC Name | 1-pyrimidin-2-ylcyclopropan-1-amine |
| InChI | InChI=1S/C7H9N3/c8-7(2-3-7)6-9-4-1-5-10-6/h1,4-5H,2-3,8H2 |
| InChI Key | OBSRDFSSNGPUIY-UHFFFAOYSA-N |
| MDL Number | MFCD16845475 |
| Molecular Formula | C7H9N3 |
| Molecular Weight | 135.1665 |
| SMILES | NC1(C2=NC=CC=N2)CC1 |
| Synonyms | 1159878-06-4,
1-(PYRIMIDIN-2-YL)CYCLOPROPAN-1-AMINE,
1-(PYRIMIDIN-2-YL)CYCLOPROPANAMINE,
SCHEMBL246118,
OBSRDFSSNGPUIY-UHFFFAOYSA-N,
MFCD16845475,
ZINC54404886,
AKOS011971870,
Cyclopropanamine, 1-(2-pyrimidinyl)-,
PB27038,
AS-51118,
DA-15172,
AJ-112304,
CS-0052798,
FT-0706269,
Q-2379,
5-Bromo-2-chloromethylyrimidine hydrochloride,
944903-00-8,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.17g/mol |
| Monoisotopic Mass | 135.08g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
|
Certificate of Analysis
Lot Number