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1152698-38-8 | 2-(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
CAS No: 1152698-38-8 Catalog No: AG00JY96 MDL No:MFCD11135953
Product Description
Catalog Number:
AG00JY96
Chemical Name:
2-(4-amino-3,5-dimethyl-1H-pyrazol-1-yl)acetonitrile
CAS Number:
1152698-38-8
Molecular Formula:
C7H10N4
Molecular Weight:
150.1811
MDL Number:
MFCD11135953
IUPAC Name:
2-(4-amino-3,5-dimethylpyrazol-1-yl)acetonitrile
InChI:
InChI=1S/C7H10N4/c1-5-7(9)6(2)11(10-5)4-3-8/h4,9H2,1-2H3
InChI Key:
BRUZUGWRKQUUOH-UHFFFAOYSA-N
SMILES:
N#CCn1nc(c(c1C)N)C
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.091g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
150.185g/mol
Monoisotopic Mass:
150.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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