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20331-68-4 | Decanoic acid, 2-propoxyethyl ester
CAS No: 20331-68-4 Catalog No: AG0028TI MDL No:
Product Description
Catalog Number:
AG0028TI
Chemical Name:
Decanoic acid, 2-propoxyethyl ester
CAS Number:
20331-68-4
Molecular Formula:
C15H30O3
Molecular Weight:
258.3969
IUPAC Name:
2-propoxyethyl decanoate
InChI:
InChI=1S/C15H30O3/c1-3-5-6-7-8-9-10-11-15(16)18-14-13-17-12-4-2/h3-14H2,1-2H3
InChI Key:
JZUGMMLTPMKIOP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)OCCOCCC
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.219g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.402g/mol
Monoisotopic Mass:
258.219g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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