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89030-26-2 | 2H-Pyran-2-one, 4-butyl-5,6-dihydro-
CAS No: 89030-26-2 Catalog No: AG00434P MDL No:
Product Description
Catalog Number:
AG00434P
Chemical Name:
2H-Pyran-2-one, 4-butyl-5,6-dihydro-
CAS Number:
89030-26-2
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
4-butyl-2,3-dihydropyran-6-one
InChI:
InChI=1S/C9H14O2/c1-2-3-4-8-5-6-11-9(10)7-8/h7H,2-6H2,1H3
InChI Key:
OTUJZXOYZDKIML-UHFFFAOYSA-N
SMILES:
CCCCC1=CC(=O)OCC1
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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