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255-17-4 | 2H-1,4-Benzothiazine(8CI,9CI)
CAS No: 255-17-4 Catalog No: AG007MSU MDL No:MFCD15203727
Product Description
Catalog Number:
AG007MSU
Chemical Name:
2H-1,4-Benzothiazine(8CI,9CI)
CAS Number:
255-17-4
Molecular Formula:
C8H7NS
Molecular Weight:
149.2129
MDL Number:
MFCD15203727
IUPAC Name:
2H-1,4-benzothiazine
InChI:
InChI=1S/C8H7NS/c1-2-4-8-7(3-1)9-5-6-10-8/h1-5H,6H2
InChI Key:
FBOSKQVOIHEWAX-UHFFFAOYSA-N
SMILES:
C1=Nc2c(SC1)cccc2
Properties
Complexity:
144
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.211g/mol
Monoisotopic Mass:
149.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
Literature
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