200,000+ products from a single source!
sales@angenechem.com
116568-90-2 | 1H-Pyrazol-3-amine, 4,5-dimethyl-, acetate (1:1)
CAS No: 116568-90-2 Catalog No: AG000CRZ MDL No:
Product Description
Catalog Number:
AG000CRZ
Chemical Name:
1H-Pyrazol-3-amine, 4,5-dimethyl-, acetate (1:1)
CAS Number:
116568-90-2
Molecular Formula:
C7H13N3O2
Molecular Weight:
171.1970
IUPAC Name:
acetic acid;4,5-dimethyl-1H-pyrazol-3-amine
InChI:
InChI=1S/C5H9N3.C2H4O2/c1-3-4(2)7-8-5(3)6;1-2(3)4/h1-2H3,(H3,6,7,8);1H3,(H,3,4)
InChI Key:
QHDXENKZSZHHHL-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c(c1C)C.CC(=O)O
Properties
Complexity:
115
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.101g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
171.2g/mol
Monoisotopic Mass:
171.101g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.