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2-hydroxy Stearic Acid methyl ester

CAT: 0931-T35703-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T35703-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2420-35-1
Target
Others
Related Pathways
Others
Bioactivity
2-hydroxy Stearic acid is a hydroxylated fatty acid methyl ester that broadens phase transition in dimyristoylphosphatidylcholine (DMPC) lipid membranes. It has been used in the synthesis of lipid-nucleotide conjugate anti-HIV agents to increase phosphodiester bond cleavage and the amount of liberated intracellular nucleotides.
Smiles
CCCCCCCCCCCCCCCCC(O)C(=O)OC
Molecular Formula
C19H38O3
Molecular Weight
314.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Methyl 2-hydroxyoctadecanoate
CAS Number2420-35-1
PubChem CID536367
IUPAC Namemethyl 2-hydroxyoctadecanoate
Molecular FormulaC19H38O3
Molecular Weight314.5
XLogP7.8
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Heavy Atom Count22
Formal Charge0
Complexity241
SMILES
CCCCCCCCCCCCCCCCC(C(=O)OC)O
InChI
InChI=1S/C19H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22-2/h18,20H,3-17H2,1-2H3
InChIKey
OUFCLLRNNJZLOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl 2-hydroxyoctadecanoate
CAS: 2420-35-1
CID: 536367
Formula: C19H38O3
MW: 314.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight314.5
XLogP37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count17
Exact Mass314.28209507
Monoisotopic Mass314.28209507
Topological Polar Surface Area46.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity241
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes