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32328-03-3 | Diethyl 3-hydroxyglutarate
CAS No: 32328-03-3 Catalog No: AG003PFR MDL No:MFCD00009202
Product Description
Catalog Number:
AG003PFR
Chemical Name:
Diethyl 3-hydroxyglutarate
CAS Number:
32328-03-3
Molecular Formula:
C9H16O5
Molecular Weight:
204.2203
MDL Number:
MFCD00009202
IUPAC Name:
diethyl 3-hydroxypentanedioate
InChI:
InChI=1S/C9H16O5/c1-3-13-8(11)5-7(10)6-9(12)14-4-2/h7,10H,3-6H2,1-2H3
InChI Key:
OLLQYIBTJXUEEX-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(CC(=O)OCC)O
EC Number:
250-992-6
NSC Number:
62681
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.222g/mol
Monoisotopic Mass:
204.1g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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