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449758-13-8 | (2-(1H-Pyrazol-1-yl)phenyl)methanamine
CAS No: 449758-13-8 Catalog No: AG003EPT MDL No:MFCD03086189
Product Description
Catalog Number:
AG003EPT
Chemical Name:
(2-(1H-Pyrazol-1-yl)phenyl)methanamine
CAS Number:
449758-13-8
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD03086189
IUPAC Name:
(2-pyrazol-1-ylphenyl)methanamine
InChI:
InChI=1S/C10H11N3/c11-8-9-4-1-2-5-10(9)13-7-3-6-12-13/h1-7H,8,11H2
InChI Key:
SJMJUZRSTJBVPG-UHFFFAOYSA-N
SMILES:
NCc1ccccc1n1cccn1
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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