Home Other Building Blocks 4-(1H-pyrazol-1-yl)oxolan-3-one

4-(1H-pyrazol-1-yl)oxolan-3-one

CAS No.:
2138420-08-1
Catalog Number:
AG01EJZB
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
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Product Description
Catalog Number:
AG01EJZB
Chemical Name:
4-(1H-pyrazol-1-yl)oxolan-3-one
CAS Number:
2138420-08-1
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD31559342
IUPAC Name:
4-pyrazol-1-yloxolan-3-one
InChI:
InChI=1S/C7H8N2O2/c10-7-5-11-4-6(7)9-3-1-2-8-9/h1-3,6H,4-5H2
InChI Key:
SZOOELRTFVUXNP-UHFFFAOYSA-N
SMILES:
O=C1COCC1n1cccn1
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties