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7495-89-8 | Nonanoic acid,3-(tetrahydro-2-furanyl)propyl ester
CAS No: 7495-89-8 Catalog No: AG005FZ3 MDL No:
Product Description
Catalog Number:
AG005FZ3
Chemical Name:
Nonanoic acid,3-(tetrahydro-2-furanyl)propyl ester
CAS Number:
7495-89-8
Molecular Formula:
C16H30O3
Molecular Weight:
270.4076
IUPAC Name:
3-(oxolan-2-yl)propyl nonanoate
InChI:
InChI=1S/C16H30O3/c1-2-3-4-5-6-7-12-16(17)19-14-9-11-15-10-8-13-18-15/h15H,2-14H2,1H3
InChI Key:
LFKPWNSEZVIRRF-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)OCCCC1CCCO1
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.219g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.413g/mol
Monoisotopic Mass:
270.219g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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