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128065-63-4

128065-63-4 | 18-Hexacosenoic acid, (Z)- (9CI)

CAS No: 128065-63-4 Catalog No: AG000XQG MDL No:

Product Description

Catalog Number:
AG000XQG
Chemical Name:
18-Hexacosenoic acid, (Z)- (9CI)
CAS Number:
128065-63-4
Molecular Formula:
C26H50O2
Molecular Weight:
394.6740
IUPAC Name:
hexacos-18-enoic acid
InChI:
InChI=1S/C26H50O2/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)28/h8-9H,2-7,10-25H2,1H3,(H,27,28)
InChI Key:
CQRBYMVSSMZBEU-UHFFFAOYSA-N
SMILES:
CCCCCCC/C=C\CCCCCCCCCCCCCCCCC(=O)O

Properties

Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.381g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
394.684g/mol
Monoisotopic Mass:
394.381g/mol
Rotatable Bond Count:
23  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
10.8  

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