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1015845-99-4 | 1H-Pyrazol-5-amine, 1-(1-ethylpropyl)-3-methyl-
CAS No: 1015845-99-4 Catalog No: AG0004W8 MDL No:MFCD08457387
Product Description
Catalog Number:
AG0004W8
Chemical Name:
1H-Pyrazol-5-amine, 1-(1-ethylpropyl)-3-methyl-
CAS Number:
1015845-99-4
Molecular Formula:
C9H17N3
Molecular Weight:
167.2514
MDL Number:
MFCD08457387
IUPAC Name:
5-methyl-2-pentan-3-ylpyrazol-3-amine
InChI:
InChI=1S/C9H17N3/c1-4-8(5-2)12-9(10)6-7(3)11-12/h6,8H,4-5,10H2,1-3H3
InChI Key:
LXCXTVZKWPDDQF-UHFFFAOYSA-N
SMILES:
CCC(n1nc(cc1N)C)CC
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.142g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.256g/mol
Monoisotopic Mass:
167.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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