Home Halogens 2-(2-bromoethyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one

2-(2-bromoethyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one

CAS No.:
139331-19-4
Catalog Number:
AG01C2HH
Molecular Formula:
C10H10BrNOS
Molecular Weight:
272.1615
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Product Description
Catalog Number:
AG01C2HH
Chemical Name:
2-(2-bromoethyl)-3,4-dihydro-2H-1,4-benzothiazin-3-one
CAS Number:
139331-19-4
Molecular Formula:
C10H10BrNOS
Molecular Weight:
272.1615
MDL Number:
MFCD28140630
IUPAC Name:
2-(2-bromoethyl)-4H-1,4-benzothiazin-3-one
InChI:
InChI=1S/C10H10BrNOS/c11-6-5-9-10(13)12-7-3-1-2-4-8(7)14-9/h1-4,9H,5-6H2,(H,12,13)
InChI Key:
WRCXYTDZMOOWSK-UHFFFAOYSA-N
SMILES:
BrCCC1Sc2ccccc2NC1=O
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.967g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
272.16g/mol
Monoisotopic Mass:
270.967g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties