| CAS Number | 1264097-17-7 |
| Catalog Number | AG000SQZ(AGN-PC-0WB6P0) |
| Chemical Name | 1H-Pyrazol-4-amine, 1-(phenylmethyl)-, hydrochloride (1:1) |
| IUPAC Name | 1-benzylpyrazol-4-amine;hydrochloride |
| InChI | InChI=1S/C10H11N3.ClH/c11-10-6-12-13(8-10)7-9-4-2-1-3-5-9;/h1-6,8H,7,11H2;1H |
| InChI Key | OVTDGUKFHSTJRM-UHFFFAOYSA-N |
| MDL Number | MFCD18425906 |
| Molecular Formula | C10H12ClN3 |
| Molecular Weight | 209.6754 |
| SMILES | NC1=CN(CC2=CC=CC=C2)N=C1.[H]Cl |
| Synonyms | 1-BENZYL-1H-PYRAZOL-4-AMINE HYDROCHLORIDE,
1264097-17-7,
1-benzylpyrazol-4-amine;hydrochloride,
SCHEMBL17822246,
BB_SC-11698,
ZX-CM006905,
MFCD18425906,
AKOS025211778,
MCULE-7815207258,
KS-00000M47,
AK480062,
DS-18907,
4029886-25G,
4029886-50G,
1H-Pyrazol-4-amine, 1-(phenylmethyl)-, hydrochloride (1:1),
(3-fluorobenzyl)(4-methoxybenzyl)amine hydrobromide,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.677g/mol |
| Monoisotopic Mass | 209.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number