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15806-45-8 | Nonanoic acid, 2-naphthalenyl ester
CAS No: 15806-45-8 Catalog No: AG001PY3 MDL No:
Product Description
Catalog Number:
AG001PY3
Chemical Name:
Nonanoic acid, 2-naphthalenyl ester
CAS Number:
15806-45-8
Molecular Formula:
C19H24O2
Molecular Weight:
284.3927
IUPAC Name:
naphthalen-2-yl nonanoate
InChI:
InChI=1S/C19H24O2/c1-2-3-4-5-6-7-12-19(20)21-18-14-13-16-10-8-9-11-17(16)15-18/h8-11,13-15H,2-7,12H2,1H3
InChI Key:
MKROVNPMTNPUNZ-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)Oc1ccc2c(c1)cccc2
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.178g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.399g/mol
Monoisotopic Mass:
284.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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