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124029-64-7

124029-64-7 | 5,9-Pentacosadienoic acid, (5Z,9Z)-

CAS No: 124029-64-7 Catalog No: AG000LF8 MDL No:

Product Description

Catalog Number:
AG000LF8
Chemical Name:
5,9-Pentacosadienoic acid, (5Z,9Z)-
CAS Number:
124029-64-7
Molecular Formula:
C25H46O2
Molecular Weight:
378.6315
IUPAC Name:
pentacosa-5,9-dienoic acid
InChI:
InChI=1S/C25H46O2/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)27/h16-17,20-21H,2-15,18-19,22-24H2,1H3,(H,26,27)
InChI Key:
XFKRINVHTWBLSV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCC/C=C\CC/C=C\CCCC(=O)O

Properties

Complexity:
357  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.35g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
378.641g/mol
Monoisotopic Mass:
378.35g/mol
Rotatable Bond Count:
21  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
10.1  

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