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20207-35-6 | Decanoic acid, 2-(hexyloxy)ethyl ester
CAS No: 20207-35-6 Catalog No: AG00281H MDL No:
Product Description
Catalog Number:
AG00281H
Chemical Name:
Decanoic acid, 2-(hexyloxy)ethyl ester
CAS Number:
20207-35-6
Molecular Formula:
C18H36O3
Molecular Weight:
300.4766
IUPAC Name:
2-hexoxyethyl decanoate
InChI:
InChI=1S/C18H36O3/c1-3-5-7-9-10-11-12-14-18(19)21-17-16-20-15-13-8-6-4-2/h3-17H2,1-2H3
InChI Key:
QMGVUPXJRIBBKF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)OCCOCCCCCC
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.266g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
300.483g/mol
Monoisotopic Mass:
300.266g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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