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89022-34-4

89022-34-4 | 5,8-Decadienoic acid, 10-[3-(3-hydroxy-1-octenyl)oxiranyl]-

CAS No: 89022-34-4 Catalog No: AG0044CT MDL No:

Product Description

Catalog Number:
AG0044CT
Chemical Name:
5,8-Decadienoic acid, 10-[3-(3-hydroxy-1-octenyl)oxiranyl]-
CAS Number:
89022-34-4
Molecular Formula:
C20H32O4
Molecular Weight:
336.4657
IUPAC Name:
10-[3-(3-hydroxyoct-1-enyl)oxiran-2-yl]deca-5,8-dienoic acid
InChI:
InChI=1S/C20H32O4/c1-2-3-9-12-17(21)15-16-19-18(24-19)13-10-7-5-4-6-8-11-14-20(22)23/h4,6-7,10,15-19,21H,2-3,5,8-9,11-14H2,1H3,(H,22,23)
InChI Key:
GELFSVXLSDZDHE-UHFFFAOYSA-N
SMILES:
CCCCCC(C=CC1OC1CC=CCC=CCCCC(=O)O)O

Properties

Complexity:
425  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.23g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
336.472g/mol
Monoisotopic Mass:
336.23g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
3  
XLogP3:
4  

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