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825603-51-8

825603-51-8 | 4H-1,3-Thiazine, 5,6-dihydro-2-(4-methylphenyl)-

CAS No: 825603-51-8 Catalog No: AG005EY1 MDL No:

Product Description

Catalog Number:
AG005EY1
Chemical Name:
4H-1,3-Thiazine, 5,6-dihydro-2-(4-methylphenyl)-
CAS Number:
825603-51-8
Molecular Formula:
C11H13NS
Molecular Weight:
191.2926
IUPAC Name:
2-(4-methylphenyl)-5,6-dihydro-4H-1,3-thiazine
InChI:
InChI=1S/C11H13NS/c1-9-3-5-10(6-4-9)11-12-7-2-8-13-11/h3-6H,2,7-8H2,1H3
InChI Key:
BDYWBBILDNUELP-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C1=NCCCS1

Properties

Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.077g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.292g/mol
Monoisotopic Mass:
191.077g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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