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

3-(1H-pyrazol-1-yl)butan-2-amine

CAS No.:
956805-00-8
Catalog Number:
AG01ABJ3
Molecular Formula:
C7H13N3
Molecular Weight:
139.1982
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Product Description
Catalog Number:
AG01ABJ3
Chemical Name:
3-(1H-pyrazol-1-yl)butan-2-amine
CAS Number:
956805-00-8
Molecular Formula:
C7H13N3
Molecular Weight:
139.1982
MDL Number:
MFCD09261650
IUPAC Name:
3-pyrazol-1-ylbutan-2-amine
InChI:
InChI=1S/C7H13N3/c1-6(8)7(2)10-5-3-4-9-10/h3-7H,8H2,1-2H3
InChI Key:
JUJSJFUYRXZKCK-UHFFFAOYSA-N
SMILES:
CC(C(n1cccn1)C)N
Properties
Complexity:
105  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.111g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
139.202g/mol
Monoisotopic Mass:
139.111g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties