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Home > Other Building Blocks > 138471-91-7
138471-91-7 | 4H-Pyran-4-one, 2,3-dihydro-5-hydroxy-
CAS No: 138471-91-7 Catalog No: AG00197P MDL No:
Product Description
Catalog Number:
AG00197P
Chemical Name:
4H-Pyran-4-one, 2,3-dihydro-5-hydroxy-
CAS Number:
138471-91-7
Molecular Formula:
C5H6O3
Molecular Weight:
114.0993
IUPAC Name:
5-hydroxy-2,3-dihydropyran-4-one
InChI:
InChI=1S/C5H6O3/c6-4-1-2-8-3-5(4)7/h3,7H,1-2H2
InChI Key:
UEEJAWIBWQWIMK-UHFFFAOYSA-N
SMILES:
O=C1CCOC=C1O
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
114.032g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
114.1g/mol
Monoisotopic Mass:
114.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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