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119368-48-8

119368-48-8 | [1-(acetylsulfanyl)propan-2-yl]trimethylazanium iodide

CAS No: 119368-48-8 Catalog No: AG01B9V0 MDL No:

Product Description

Catalog Number:
AG01B9V0
Chemical Name:
[1-(acetylsulfanyl)propan-2-yl]trimethylazanium iodide
CAS Number:
119368-48-8
Molecular Formula:
C8H18INOS
Molecular Weight:
303.2041
IUPAC Name:
1-acetylsulfanylpropan-2-yl(trimethyl)azanium;iodide
InChI:
InChI=1S/C8H18NOS.HI/c1-7(9(3,4)5)6-11-8(2)10;/h7H,6H2,1-5H3;1H/q+1;/p-1
InChI Key:
ZFUSGTSGTGOWAT-UHFFFAOYSA-M
SMILES:
CC(=O)SCC([N+](C)(C)C)C.[I-]

Properties

Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.015g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.202g/mol
Monoisotopic Mass:
303.015g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0

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