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114275-41-1 | Propanoic acid, 2,2-dimethyl-, 2-azido-3-hydroxy-4-octadecenyl ester, [R-[R*,S*-(E)]]- (9CI)
CAS No: 114275-41-1 Catalog No: AG000AZ1 MDL No:
Product Description
Catalog Number:
AG000AZ1
Chemical Name:
Propanoic acid, 2,2-dimethyl-, 2-azido-3-hydroxy-4-octadecenyl ester, [R-[R*,S*-(E)]]- (9CI)
CAS Number:
114275-41-1
IUPAC Name:
[(E,2S,3R)-2-azido-3-hydroxyoctadec-4-enyl] 2,2-dimethylpropanoate
InChI:
InChI=1S/C23H43N3O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(27)20(25-26-24)19-29-22(28)23(2,3)4/h17-18,20-21,27H,5-16,19H2,1-4H3/b18-17+/t20-,21+/m0/s1
InChI Key:
HBQMTKUQTNSGBI-BWMVHVDHSA-N
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
1
Exact Mass:
409.33g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
409.615g/mol
Monoisotopic Mass:
409.33g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.1
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