Home Other Building Blocks 2-(1-phenyl-1H-pyrazol-3-yl)ethan-1-amine

2-(1-phenyl-1H-pyrazol-3-yl)ethan-1-amine

CAS No.:
1240526-44-6
Catalog Number:
AG01A8VO
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
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Product Description
Catalog Number:
AG01A8VO
Chemical Name:
2-(1-phenyl-1H-pyrazol-3-yl)ethan-1-amine
CAS Number:
1240526-44-6
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD02853702
IUPAC Name:
2-(1-phenylpyrazol-3-yl)ethanamine
InChI:
InChI=1S/C11H13N3/c12-8-6-10-7-9-14(13-10)11-4-2-1-3-5-11/h1-5,7,9H,6,8,12H2
InChI Key:
URRPTBKQFRZAHO-UHFFFAOYSA-N
SMILES:
NCCc1ccn(n1)c1ccccc1
Properties
Complexity:
166  
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:
3  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties