Home Other Building Blocks 3-(1H-pyrazol-1-yl)cyclobutan-1-one

3-(1H-pyrazol-1-yl)cyclobutan-1-one

CAS No.:
1704377-50-3
Catalog Number:
AG01B8W3
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
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Product Description
Catalog Number:
AG01B8W3
Chemical Name:
3-(1H-pyrazol-1-yl)cyclobutan-1-one
CAS Number:
1704377-50-3
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
MDL Number:
MFCD29041033
IUPAC Name:
3-pyrazol-1-ylcyclobutan-1-one
InChI:
InChI=1S/C7H8N2O/c10-7-4-6(5-7)9-3-1-2-8-9/h1-3,6H,4-5H2
InChI Key:
BJQOHWJWQPHKQV-UHFFFAOYSA-N
SMILES:
O=C1CC(C1)n1cccn1
Properties
Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.064g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.154g/mol
Monoisotopic Mass:
136.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  
Properties