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1007520-12-8 | 1H-Pyrazole-4-methanamine, N,3,5-trimethyl-1-(1-methylethyl)-
CAS No: 1007520-12-8 Catalog No: AG0002SS MDL No:MFCD08691487
Product Description
Catalog Number:
AG0002SS
Chemical Name:
1H-Pyrazole-4-methanamine, N,3,5-trimethyl-1-(1-methylethyl)-
CAS Number:
1007520-12-8
Molecular Formula:
C10H19N3
Molecular Weight:
181.2780
MDL Number:
MFCD08691487
IUPAC Name:
1-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-N-methylmethanamine
InChI:
InChI=1S/C10H19N3/c1-7(2)13-9(4)10(6-11-5)8(3)12-13/h7,11H,6H2,1-5H3
InChI Key:
NGQAVIYYCCTQAU-UHFFFAOYSA-N
SMILES:
CNCc1c(C)nn(c1C)C(C)C
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.158g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.283g/mol
Monoisotopic Mass:
181.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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