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79728-54-4

79728-54-4 | 8-Decenoic acid,10-hydroxy-

CAS No: 79728-54-4 Catalog No: AG0056CB MDL No:

Product Description

Catalog Number:
AG0056CB
Chemical Name:
8-Decenoic acid,10-hydroxy-
CAS Number:
79728-54-4
Molecular Formula:
C10H18O3
Molecular Weight:
186.2481
IUPAC Name:
(E)-10-hydroxydec-8-enoic acid
InChI:
InChI=1S/C10H18O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h5,7,11H,1-4,6,8-9H2,(H,12,13)/b7-5+
InChI Key:
RCXJFGCVOBRFEH-FNORWQNLSA-N
SMILES:
OCC=CCCCCCCC(=O)O

Properties

Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
186.126g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
186.251g/mol
Monoisotopic Mass:
186.126g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

Literature

Title Journal
Vertilecanins: new phenopicolinic acid analogues from Verticillium lecanii. Journal of natural products 20010201

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