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2519-24-6 | 2-Cyclopentene-1-nonanoic acid
CAS No: 2519-24-6 Catalog No: AG002QTC MDL No:
Product Description
Catalog Number:
AG002QTC
Chemical Name:
2-Cyclopentene-1-nonanoic acid
CAS Number:
2519-24-6
Molecular Formula:
C14H24O2
Molecular Weight:
224.3392
IUPAC Name:
9-cyclopent-2-en-1-ylnonanoic acid
InChI:
InChI=1S/C14H24O2/c15-14(16)12-6-4-2-1-3-5-9-13-10-7-8-11-13/h7,10,13H,1-6,8-9,11-12H2,(H,15,16)
InChI Key:
DTHSUAKYTFUSQU-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCC1C=CCC1
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.178g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.344g/mol
Monoisotopic Mass:
224.178g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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