Home Other Building Blocks 3-(heptan-3-yl)-1H-pyrazol-5-amine

3-(heptan-3-yl)-1H-pyrazol-5-amine

CAS No.:
110086-14-1
Catalog Number:
AG019S3F
Molecular Formula:
C10H19N3
Molecular Weight:
181.2780
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Product Description
Catalog Number:
AG019S3F
Chemical Name:
3-(heptan-3-yl)-1H-pyrazol-5-amine
CAS Number:
110086-14-1
Molecular Formula:
C10H19N3
Molecular Weight:
181.2780
MDL Number:
MFCD11194935
IUPAC Name:
5-heptan-3-yl-1H-pyrazol-3-amine
InChI:
InChI=1S/C10H19N3/c1-3-5-6-8(4-2)9-7-10(11)13-12-9/h7-8H,3-6H2,1-2H3,(H3,11,12,13)
InChI Key:
FITREMZWOJSQAT-UHFFFAOYSA-N
SMILES:
CCCCC(c1n[nH]c(c1)N)CC
Properties
Complexity:
138  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.158g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.283g/mol
Monoisotopic Mass:
181.158g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties