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cis-5-Dodecenoic acid

CAS No.:
2430-94-6
Catalog Number:
AG003OZI
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
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Product Description
Catalog Number:
AG003OZI
Chemical Name:
cis-5-Dodecenoic acid
CAS Number:
2430-94-6
Molecular Formula:
C12H22O2
Molecular Weight:
198.3019
MDL Number:
MFCD00239341
IUPAC Name:
(Z)-dodec-5-enoic acid
InChI:
InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h7-8H,2-6,9-11H2,1H3,(H,13,14)/b8-7-
InChI Key:
IJBFSOLHRKELLR-FPLPWBNLSA-N
SMILES:
CCCCCC/C=C\CCCC(=O)O
Properties
Complexity:
162  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
198.162g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.306g/mol
Monoisotopic Mass:
198.162g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
An efficient and economical MTT assay for determining the antioxidant activity of plant natural product extracts and pure compounds. Journal of natural products 20100723
Escherichia coli unsaturated fatty acid synthesis: complex transcription of the fabA gene and in vivo identification of the essential reaction catalyzed by FabB. The Journal of biological chemistry 20091023
Properties