Home Other Building Blocks 5-tert-butyloxolan-2-one

5-tert-butyloxolan-2-one

CAS No.:
21175-44-0
Catalog Number:
AG01EHRE
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
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Product Description
Catalog Number:
AG01EHRE
Chemical Name:
5-tert-butyloxolan-2-one
CAS Number:
21175-44-0
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
MDL Number:
MFCD31446541
IUPAC Name:
5-tert-butyloxolan-2-one
InChI:
InChI=1S/C8H14O2/c1-8(2,3)6-4-5-7(9)10-6/h6H,4-5H2,1-3H3
InChI Key:
JOOOWMKNPUTDKK-UHFFFAOYSA-N
SMILES:
CC(C1CCC(=O)O1)(C)C
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties