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1157012-73-1 | 4-Methyl-1-(oxan-4-yl)-1H-pyrazol-5-amine
CAS No: 1157012-73-1 Catalog No: AG01FBGU MDL No:
Product Description
Catalog Number:
AG01FBGU
Chemical Name:
4-Methyl-1-(oxan-4-yl)-1H-pyrazol-5-amine
CAS Number:
1157012-73-1
Molecular Formula:
C9H15N3O
Molecular Weight:
181.2349
IUPAC Name:
4-methyl-2-(oxan-4-yl)pyrazol-3-amine
InChI:
InChI=1S/C9H15N3O/c1-7-6-11-12(9(7)10)8-2-4-13-5-3-8/h6,8H,2-5,10H2,1H3
InChI Key:
MVZYPZLWSYXVPW-UHFFFAOYSA-N
SMILES:
Nc1c(C)cnn1C1CCOCC1
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.122g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.239g/mol
Monoisotopic Mass:
181.122g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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