| CAS Number | 1156169-29-7 |
| Catalog Number | AG019SZO(AGN-PC-0WO1S7) |
| Chemical Name | 1-(Cyclopropylmethyl)-1H-pyrazol-4-amine |
| IUPAC Name | 1-(cyclopropylmethyl)pyrazol-4-amine |
| InChI | InChI=1S/C7H11N3/c8-7-3-9-10(5-7)4-6-1-2-6/h3,5-6H,1-2,4,8H2 |
| InChI Key | MHSVYNAOIXCBLJ-UHFFFAOYSA-N |
| MDL Number | MFCD12138807 |
| Molecular Formula | C7H11N3 |
| Molecular Weight | 137.1823 |
| SMILES | NC1=CN(CC2CC2)N=C1 |
| Synonyms | 1-(cyclopropylmethyl)-1H-pyrazol-4-amine,
1156169-29-7,
1H-Pyrazol-4-amine, 1-(cyclopropylmethyl)-,
SCHEMBL3259744,
MHSVYNAOIXCBLJ-UHFFFAOYSA-N,
ZINC36765347,
1-(cyclopropylmethyl)pyrazol-4-amine,
AKOS008135436,
MCULE-5559082420,
NE54977,
CS-0088079,
FT-0761142,
F2147-1727,
|
| Complexity | 122 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 137.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 137.186g/mol |
| Monoisotopic Mass | 137.095g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H302-H315-H318-H335
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P310-P330-P332+P313-P362-P403+P233-P405-P501
|
|
UN Code
|
UN 2735
|
Certificate of Analysis
Lot Number