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68378-48-3 | 9,12,15,18,21-Tetracosapentaenoic acid, (9Z,12Z,15Z,18Z,21Z)-
CAS No: 68378-48-3 Catalog No: AG01FGAE MDL No:
Product Description
Catalog Number:
AG01FGAE
Chemical Name:
9,12,15,18,21-Tetracosapentaenoic acid, (9Z,12Z,15Z,18Z,21Z)-
CAS Number:
68378-48-3
Molecular Formula:
C24H38O2
Molecular Weight:
358.5573
IUPAC Name:
tetracosa-9,12,15,18,21-pentaenoic acid
InChI:
InChI=1S/C24H38O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-23H2,1H3,(H,25,26)
InChI Key:
NPTIBOCVSPURCS-UHFFFAOYSA-N
SMILES:
CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.287g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.566g/mol
Monoisotopic Mass:
358.287g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
5
XLogP3:
7.7
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