| CAS Number | 1007488-78-9 |
| Catalog Number | AG0002RB(AGN-PC-0WB3PI) |
| Chemical Name | 1H-PYRAZOLE-1-PROPANAMINE, N-METHYL- |
| IUPAC Name | N-methyl-3-pyrazol-1-ylpropan-1-amine |
| InChI | InChI=1S/C7H13N3/c1-8-4-2-6-10-7-3-5-9-10/h3,5,7-8H,2,4,6H2,1H3 |
| InChI Key | GIGRBVGROITPDQ-UHFFFAOYSA-N |
| MDL Number | MFCD08701102 |
| Molecular Formula | C7H13N3 |
| Molecular Weight | 139.1982 |
| SMILES | N1=CC=CN1CCCNC |
| Synonyms | N-Methyl-3-(1H-pyrazol-1-yl)propan-1-amine,
1007488-78-9,
SCHEMBL2284058,
CTK3J9205,
DTXSID80629697,
GIGRBVGROITPDQ-UHFFFAOYSA-N,
MFCD08701102,
ZINC19091040,
AKOS003673637,
1H-Pyrazole-1-propanamine, N-methyl-,
methyl-(3-pyrazol-1-yl-propyl)-amine,
AJ-71531,
methyl[3-(1H-pyrazol-1-yl)propyl]amine,
N-Methyl-3-(1H-pyrazol-1-yl)-1-propanamine,
Y-4663,
N-Methyl-3-(1H-pyrazol-1-yl)propan-1-amine, AldrichCPR,
|
| Complexity | 84.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.202g/mol |
| Monoisotopic Mass | 139.111g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
Lot Number