| CAS Number | 1006349-08-1 |
| Catalog Number | AG0002J5(AGN-PC-0WBA7P) |
| Chemical Name | 1H-Pyrazol-3-amine, 4-chloro-1-methyl- |
| IUPAC Name | 4-chloro-1-methylpyrazol-3-amine |
| InChI | InChI=1S/C4H6ClN3/c1-8-2-3(5)4(6)7-8/h2H,1H3,(H2,6,7) |
| InChI Key | LHQLULJEAHPAHY-UHFFFAOYSA-N |
| MDL Number | MFCD04970039 |
| Molecular Formula | C4H6ClN3 |
| Molecular Weight | 131.5635 |
| SMILES | ClC=1C(=NN(C1)C)N |
| Synonyms | 4-chloro-1-methyl-1H-pyrazol-3-amine,
1006349-08-1,
4-chloro-1-methylpyrazole-3-ylamine,
SCHEMBL16178297,
CTK6I2076,
DTXSID80599104,
ZINC2537812,
SBB022306,
STK351019,
AKOS000310700,
FS-6518,
MCULE-2914572873,
4-Chloro-1-methyl-1H-pyrazol-3-ylamine,
AJ-38726,
1H-Pyrazol-3-amine, 4-chloro-1-methyl-,
ST45115818,
4-Chloro-1-methyl-1H-pyrazol-3-ylamine hydrochloride,
Z1741968736,
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| Complexity | 87.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.025g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.563g/mol |
| Monoisotopic Mass | 131.025g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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