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1016521-21-3

1016521-21-3 | 6-methanesulfonyl-1,2,3,4-tetrahydroquinoline

CAS No: 1016521-21-3 Catalog No: AG019MWV MDL No:MFCD09929119

Product Description

Catalog Number:
AG019MWV
Chemical Name:
6-methanesulfonyl-1,2,3,4-tetrahydroquinoline
CAS Number:
1016521-21-3
Molecular Formula:
C10H13NO2S
Molecular Weight:
211.2807
MDL Number:
MFCD09929119
IUPAC Name:
6-methylsulfonyl-1,2,3,4-tetrahydroquinoline
InChI:
InChI=1S/C10H13NO2S/c1-14(12,13)9-4-5-10-8(7-9)3-2-6-11-10/h4-5,7,11H,2-3,6H2,1H3
InChI Key:
FBCGZNQGQDPYAH-UHFFFAOYSA-N
SMILES:
CS(=O)(=O)c1ccc2c(c1)CCCN2

Properties

Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.279g/mol
Monoisotopic Mass:
211.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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