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1555845-37-8

1555845-37-8 | 7-methyl-3,4-dihydro-2H-1lambda6,4-benzothiazine-1,1-dione

CAS No: 1555845-37-8 Catalog No: AG01BPGS MDL No:MFCD29988521

Product Description

Catalog Number:
AG01BPGS
Chemical Name:
7-methyl-3,4-dihydro-2H-1lambda6,4-benzothiazine-1,1-dione
CAS Number:
1555845-37-8
Molecular Formula:
C9H11NO2S
Molecular Weight:
197.2541
MDL Number:
MFCD29988521
IUPAC Name:
7-methyl-3,4-dihydro-2H-1λ6,4-benzothiazine 1,1-dioxide
InChI:
InChI=1S/C9H11NO2S/c1-7-2-3-8-9(6-7)13(11,12)5-4-10-8/h2-3,6,10H,4-5H2,1H3
InChI Key:
NOUZBILAZWEOPD-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)S(=O)(=O)CCN2

Properties

Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.252g/mol
Monoisotopic Mass:
197.051g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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