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24824-70-2 | 2-Oxiraneoctanoic acid, 3-octyl-, hexyl ester
CAS No: 24824-70-2 Catalog No: AG002PK7 MDL No:
Product Description
Catalog Number:
AG002PK7
Chemical Name:
2-Oxiraneoctanoic acid, 3-octyl-, hexyl ester
CAS Number:
24824-70-2
Molecular Formula:
C24H46O3
Molecular Weight:
382.6202
IUPAC Name:
hexyl 8-(3-octyloxiran-2-yl)octanoate
InChI:
InChI=1S/C24H46O3/c1-3-5-7-9-11-14-18-22-23(27-22)19-15-12-10-13-16-20-24(25)26-21-17-8-6-4-2/h22-23H,3-21H2,1-2H3
InChI Key:
OCUXLSGBNRCHFU-UHFFFAOYSA-N
SMILES:
CCCCCCCCC1OC1CCCCCCCC(=O)OCCCCCC
EC Number:
246-482-8
UNII:
07D1EU0PO6
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
382.345g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
382.629g/mol
Monoisotopic Mass:
382.345g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
8.8
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