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101489-01-4

101489-01-4 | 2-Hexenoic acid, 2-ethyl-, (2E)-

CAS No: 101489-01-4 Catalog No: AG0004LL MDL No:

Product Description

Catalog Number:
AG0004LL
Chemical Name:
2-Hexenoic acid, 2-ethyl-, (2E)-
CAS Number:
101489-01-4
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
IUPAC Name:
2-ethylhex-2-enoic acid
InChI:
InChI=1S/C8H14O2/c1-3-5-6-7(4-2)8(9)10/h6H,3-5H2,1-2H3,(H,9,10)
InChI Key:
WOWYPHJOHOCYII-UHFFFAOYSA-N
SMILES:
CCC/C=C(/C(=O)O)\CC

Properties

Complexity:
136  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.4  

Literature

Title Journal
Copper(II) complexes incorporating poly/perfluorinated alkoxyaluminate-type weakly coordinating anions: syntheses, characterization and catalytic application in stereoselective olefin aziridination. Dalton transactions (Cambridge, England : 2003) 20110607
An efficient sequential reaction process to polysubstituted indolizidines and quinolizidines and its application to the total synthesis of indolizidine 223A. Organic letters 20050217
Identification and quantitation of extractables from cellulose acetate butyrate (CAB) and estimation of their in vivo exposure levels. Journal of pharmaceutical and biomedical analysis 20040629
Monitoring and fast detection of mycotoxin-producing fungi based on headspace solid-phase microextraction and headspace sorptive extraction of the volatile metabolites. Journal of chromatography. A 20030124

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