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13107-53-4 | Pentanoic acid, 5-hydroxy-, ethyl ester
CAS No: 13107-53-4 Catalog No: AG000VHH MDL No:
Product Description
Catalog Number:
AG000VHH
Chemical Name:
Pentanoic acid, 5-hydroxy-, ethyl ester
CAS Number:
13107-53-4
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
IUPAC Name:
ethyl 5-hydroxypentanoate
InChI:
InChI=1S/C7H14O3/c1-2-10-7(9)5-3-4-6-8/h8H,2-6H2,1H3
InChI Key:
FKHNTGWOIDULDM-UHFFFAOYSA-N
SMILES:
OCCCCC(=O)OCC
Properties
Complexity:
90.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.094g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.186g/mol
Monoisotopic Mass:
146.094g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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