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1196153-72-6 | 1H-Pyrazole-3-methanamine, hydrochloride (1:1)
CAS No: 1196153-72-6 Catalog No: AG000PB4 MDL No:MFCD22495364
Product Description
Catalog Number:
AG000PB4
Chemical Name:
1H-Pyrazole-3-methanamine, hydrochloride (1:1)
CAS Number:
1196153-72-6
Molecular Formula:
C4H8ClN3
Molecular Weight:
133.5794
MDL Number:
MFCD22495364
IUPAC Name:
1H-pyrazol-5-ylmethanamine;hydrochloride
InChI:
InChI=1S/C4H7N3.ClH/c5-3-4-1-2-6-7-4;/h1-2H,3,5H2,(H,6,7);1H
InChI Key:
CJXGXVKUSRZGNX-UHFFFAOYSA-N
SMILES:
NCc1cc[nH]n1.Cl
Properties
Complexity:
54.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
133.041g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
133.579g/mol
Monoisotopic Mass:
133.041g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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