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1001635-21-7 | 1H-Pyrazole-4-methanol, 3-amino-
CAS No: 1001635-21-7 Catalog No: AG00014P MDL No:
Product Description
Catalog Number:
AG00014P
Chemical Name:
1H-Pyrazole-4-methanol, 3-amino-
CAS Number:
1001635-21-7
Molecular Formula:
C4H7N3O
Molecular Weight:
113.1179
IUPAC Name:
(5-amino-1H-pyrazol-4-yl)methanol
InChI:
InChI=1S/C4H7N3O/c5-4-3(2-8)1-6-7-4/h1,8H,2H2,(H3,5,6,7)
InChI Key:
AJQBUGTVJCZIRH-UHFFFAOYSA-N
SMILES:
Nc1n[nH]cc1CO
Properties
Complexity:
77.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.059g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
113.12g/mol
Monoisotopic Mass:
113.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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