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67190-02-7

67190-02-7 | Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, chloride

CAS No: 67190-02-7 Catalog No: AG006K9L MDL No:

Product Description

Catalog Number:
AG006K9L
Chemical Name:
Quinolinium, 1-ethyl-2-(ethylthio)-6-methyl-, chloride
CAS Number:
67190-02-7
Molecular Formula:
C14H18ClNS
Molecular Weight:
267.8174
IUPAC Name:
1-ethyl-2-ethylsulfanyl-6-methylquinolin-1-ium;chloride
InChI:
InChI=1S/C14H18NS.ClH/c1-4-15-13-8-6-11(3)10-12(13)7-9-14(15)16-5-2;/h6-10H,4-5H2,1-3H3;1H/q+1;/p-1
InChI Key:
REODKGFTIIXTQS-UHFFFAOYSA-M
SMILES:
CCSc1ccc2c([n+]1CC)ccc(c2)C.[Cl-]

Properties

Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.085g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.815g/mol
Monoisotopic Mass:
267.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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