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Home Other Building Blocks HEXADECANOIC-D31 ACID

HEXADECANOIC-D31 ACID

CAS No.:
39756-30-4
Catalog Number:
AG00BZL9
Molecular Formula:
C16HD31O2
Molecular Weight:
287.6151
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥99% deuterated forms (d<sub>1</sub>-d<sub>31</sub>)
1 week
United States
$119
- +
500mg
≥99% deuterated forms (d<sub>1</sub>-d<sub>31</sub>)
1 week
United States
$307
- +
1g
≥99% deuterated forms (d<sub>1</sub>-d<sub>31</sub>)
1 week
United States
$432
- +
Product Description
Catalog Number:
AG00BZL9
Chemical Name:
HEXADECANOIC-D31 ACID
CAS Number:
39756-30-4
Molecular Formula:
C16HD31O2
Molecular Weight:
287.6151
MDL Number:
MFCD00053335
IUPAC Name:
2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-hentriacontadeuteriohexadecanoic acid
InChI:
InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i1D3,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2
InChI Key:
IPCSVZSSVZVIGE-SAQPIRCFSA-N
SMILES:
OC(=O)C(C(C(C(C(C(C(C(C(C(C(C(C(C(C([2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H]
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.435g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
31  
Molecular Weight:
287.619g/mol
Monoisotopic Mass:
287.435g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4  
Literature
Title Journal
Reflections on my career in analytical chemistry and biochemistry. Proceedings of the Japan Academy. Series B, Physical and biological sciences 20101008
The microstructure of the stratum corneum lipid barrier: mid-infrared spectroscopic studies of hydrated ceramide:palmitic acid:cholesterol model systems. Biophysical chemistry 20100801
Inhibition of the acyl-CoA desaturases involved in the biosynthesis of Spodoptera littoralis sex pheromone by analogs of 10,11-methylene-10-tetradecenoic acid. Insect biochemistry and molecular biology 20040301
FTIR spectroscopic analyses of the temperature and pH influences on stratum corneum lipid phase behaviors and interactions. Talanta 20020304
De novo arachidonic acid synthesis in Perkinsus marinus, a protozoan parasite of the eastern oyster Crassostrea virginica. Molecular and biochemical parasitology 20020201
Properties