Home Aminos 9-Octadecenoic acid (9Z)-,(1R)-1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediylester

9-Octadecenoic acid (9Z)-,(1R)-1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediylester

CAS No.:
4004-05-1
Catalog Number:
AG00IMFR
Molecular Formula:
C41H78NO8P
Molecular Weight:
744.0337
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥98%
1 week
United States
$147
- +
250mg
≥98%
1 week
United States
$193
- +
500mg
≥98%
1 week
United States
$305
- +
Product Description
Catalog Number:
AG00IMFR
Chemical Name:
9-Octadecenoic acid (9Z)-,(1R)-1-[[[(2-aminoethoxy)hydroxyphosphinyl]oxy]methyl]-1,2-ethanediylester
CAS Number:
4004-05-1
Molecular Formula:
C41H78NO8P
Molecular Weight:
744.0337
MDL Number:
MFCD16621009
IUPAC Name:
[(2R)-3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-[(Z)-octadec-9-enoyl]oxypropyl] (Z)-octadec-9-enoate
InChI:
InChI=1S/C41H78NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,39H,3-16,21-38,42H2,1-2H3,(H,45,46)/b19-17-,20-18-/t39-/m1/s1
InChI Key:
MWRBNPKJOOWZPW-NYVOMTAGSA-N
SMILES:
CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@@H](OC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(OCC[NH3+])[O-]
UNII:
JNP6V6AI0U
Properties
Complexity:
897  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
2  
Exact Mass:
743.547g/mol
Formal Charge:
0
Heavy Atom Count:
51  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
744.048g/mol
Monoisotopic Mass:
743.547g/mol
Rotatable Bond Count:
41  
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.6  
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Properties