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89635-92-7 | 1-Propanol, 2-methoxy-3-(octadecyloxy)-, methanesulfonate, (R)-
CAS No: 89635-92-7 Catalog No: AG003WIK MDL No:
Product Description
Catalog Number:
AG003WIK
Chemical Name:
1-Propanol, 2-methoxy-3-(octadecyloxy)-, methanesulfonate, (R)-
CAS Number:
89635-92-7
Molecular Formula:
C23H50O6S
Molecular Weight:
454.7045
IUPAC Name:
methanesulfonic acid;2-methoxy-3-octadecoxypropan-1-ol
InChI:
InChI=1S/C22H46O3.CH4O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25-21-22(20-23)24-2;1-5(2,3)4/h22-23H,3-21H2,1-2H3;1H3,(H,2,3,4)
InChI Key:
PFCMNWVMEGARSE-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)O.CCCCCCCCCCCCCCCCCCOC[C@@H](CO)OC
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
454.333g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
454.707g/mol
Monoisotopic Mass:
454.333g/mol
Rotatable Bond Count:
21
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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