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3036-89-3 | 5,8,11,14-nonadecatetraenoic acid
CAS No: 3036-89-3 Catalog No: AG002ZVF MDL No:
Product Description
Catalog Number:
AG002ZVF
Chemical Name:
5,8,11,14-nonadecatetraenoic acid
CAS Number:
3036-89-3
Molecular Formula:
C19H30O2
Molecular Weight:
290.4403
IUPAC Name:
(5E,8E,11E,14E)-nonadeca-5,8,11,14-tetraenoic acid
InChI:
InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h5-6,8-9,11-12,14-15H,2-4,7,10,13,16-18H2,1H3,(H,20,21)/b6-5+,9-8+,12-11+,15-14+
InChI Key:
PPGFCKXUIAVTFL-SFYIKTPXSA-N
SMILES:
CCCCC=CCC=CCC=CCC=CCCCC(=O)O
Properties
Complexity:
349
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4
Exact Mass:
290.225g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.447g/mol
Monoisotopic Mass:
290.225g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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