Home Other Building Blocks [3-(1-methyl-1H-pyrazol-4-yl)phenyl]methanamine

[3-(1-methyl-1H-pyrazol-4-yl)phenyl]methanamine

CAS No.:
1178650-39-9
Catalog Number:
AG01A3FE
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
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Product Description
Catalog Number:
AG01A3FE
Chemical Name:
[3-(1-methyl-1H-pyrazol-4-yl)phenyl]methanamine
CAS Number:
1178650-39-9
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD11932705
IUPAC Name:
[3-(1-methylpyrazol-4-yl)phenyl]methanamine
InChI:
InChI=1S/C11H13N3/c1-14-8-11(7-13-14)10-4-2-3-9(5-10)6-12/h2-5,7-8H,6,12H2,1H3
InChI Key:
ZGRQVGOBMMJNSV-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)c1cnn(c1)C
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/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  
Properties