Home Other Building Blocks 1H-pyrazol-4-ylmethylamine

1H-pyrazol-4-ylmethylamine

CAS No.:
37599-59-0
Catalog Number:
AG00CIRN
Molecular Formula:
C4H7N3
Molecular Weight:
97.1185
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Product Description
Catalog Number:
AG00CIRN
Chemical Name:
1H-pyrazol-4-ylmethylamine
CAS Number:
37599-59-0
Molecular Formula:
C4H7N3
Molecular Weight:
97.1185
MDL Number:
MFCD08700553
IUPAC Name:
1H-pyrazol-4-ylmethanamine
InChI:
InChI=1S/C4H7N3/c5-1-4-2-6-7-3-4/h2-3H,1,5H2,(H,6,7)
InChI Key:
LIDZELUIEIAIDJ-UHFFFAOYSA-N
SMILES:
NCc1c[nH]nc1
Properties
Complexity:
54.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.064g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
97.121g/mol
Monoisotopic Mass:
97.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties