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137905-29-4

137905-29-4 | 4-Octadecen-1-ol, 2-amino-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, [R-[R*,S*-(E)]]- (9CI)

CAS No: 137905-29-4 Catalog No: AG00143A MDL No:

Product Description

Catalog Number:
AG00143A
Chemical Name:
4-Octadecen-1-ol, 2-amino-3-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, [R-[R*,S*-(E)]]- (9CI)
CAS Number:
137905-29-4
Molecular Formula:
C24H51NO2Si
Molecular Weight:
413.7527
IUPAC Name:
(E,2S,3R)-2-amino-3-[tert-butyl(dimethyl)silyl]oxyoctadec-4-en-1-ol
InChI:
InChI=1S/C24H51NO2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(22(25)21-26)27-28(5,6)24(2,3)4/h19-20,22-23,26H,7-18,21,25H2,1-6H3/b20-19+/t22-,23+/m0/s1
InChI Key:
OFASSHVVQGEKIT-DWVLVAQTSA-N
SMILES:
CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O[Si](C(C)(C)C)(C)C

Properties

Complexity:
391  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
1  
Exact Mass:
413.369g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
413.762g/mol
Monoisotopic Mass:
413.369g/mol
Rotatable Bond Count:
18  
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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