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115422-11-2

115422-11-2 | 1-Hexadecanethiol, 16-methoxy-

CAS No: 115422-11-2 Catalog No: AG000FYY MDL No:

Product Description

Catalog Number:
AG000FYY
Chemical Name:
1-Hexadecanethiol, 16-methoxy-
CAS Number:
115422-11-2
Molecular Formula:
C17H36OS
Molecular Weight:
288.5321
IUPAC Name:
16-methoxyhexadecane-1-thiol
InChI:
InChI=1S/C17H36OS/c1-18-16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19/h19H,2-17H2,1H3
InChI Key:
LKYHXNVMXYFGPH-UHFFFAOYSA-N
SMILES:
COCCCCCCCCCCCCCCCCS

Properties

Complexity:
150  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.249g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
288.534g/mol
Monoisotopic Mass:
288.249g/mol
Rotatable Bond Count:
16  
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  

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