Home Carboxys 4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid

4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid

CAS No.:
218137-86-1
Catalog Number:
AG00BE8S
Molecular Formula:
C14H22O4
Molecular Weight:
254.3221
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$223
- +
10mg
99%
1 week
United States
$333
- +
50mg
99%
1 week
United States
$1226
- +
Product Description
Catalog Number:
AG00BE8S
Chemical Name:
4-Methylene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid
CAS Number:
218137-86-1
Molecular Formula:
C14H22O4
Molecular Weight:
254.3221
MDL Number:
MFCD03426157
IUPAC Name:
4-methylidene-2-octyl-5-oxooxolane-3-carboxylic acid
InChI:
InChI=1S/C14H22O4/c1-3-4-5-6-7-8-9-11-12(13(15)16)10(2)14(17)18-11/h11-12H,2-9H2,1H3,(H,15,16)
InChI Key:
VCWLZDVWHQVAJU-UHFFFAOYSA-N
SMILES:
CCCCCCCCC1OC(=O)C(=C)C1C(=O)O
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.152g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
254.326g/mol
Monoisotopic Mass:
254.152g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Literature
Title Journal
Synthesis and biological activity of enantiomeric pairs of 5-[(E)-cycloalk-2-enylidenemethyl]thiolactomycin congeners. Bioorganic & medicinal chemistry letters 20081015
Properties