200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 127039-55-8
127039-55-8 | Eicosanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester, (R)- (9CI)
CAS No: 127039-55-8 Catalog No: AG000WMC MDL No:
Product Description
Catalog Number:
AG000WMC
Chemical Name:
Eicosanoic acid, 1-(hydroxymethyl)-1,2-ethanediyl ester, (R)- (9CI)
CAS Number:
127039-55-8
Molecular Formula:
C43H84O5
Molecular Weight:
681.1241
IUPAC Name:
2,3-dihydroxypropyl icosanoate;icosanoate
InChI:
InChI=1S/C23H46O4.C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-21-22(25)20-24;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h22,24-25H,2-21H2,1H3;2-19H2,1H3,(H,21,22)/p-1
InChI Key:
AQUTZWLLBAXFHV-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](OC(=O)CCCCCCCCCCCCCCCCCCC)CO
Properties
Complexity:
527
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
697.635g/mol
Formal Charge:
-1
Heavy Atom Count:
49
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
698.147g/mol
Monoisotopic Mass:
697.635g/mol
Rotatable Bond Count:
39
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.