Home Other Building Blocks 5-benzyloxolan-2-one

5-benzyloxolan-2-one

CAS No.:
21175-42-8
Catalog Number:
AG01A05Q
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
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Product Description
Catalog Number:
AG01A05Q
Chemical Name:
5-benzyloxolan-2-one
CAS Number:
21175-42-8
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD22378632
IUPAC Name:
5-benzyloxolan-2-one
InChI:
InChI=1S/C11H12O2/c12-11-7-6-10(13-11)8-9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
OJKCYERWEGKEIS-UHFFFAOYSA-N
SMILES:
O=C1CCC(O1)Cc1ccccc1
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.084g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.215g/mol
Monoisotopic Mass:
176.084g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties