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2786-43-8 | 2(3H)-Benzothiazoleselone, 3-methyl-
CAS No: 2786-43-8 Catalog No: AG002UYT MDL No:
Product Description
Catalog Number:
AG002UYT
Chemical Name:
2(3H)-Benzothiazoleselone, 3-methyl-
CAS Number:
2786-43-8
Molecular Formula:
C8H7NSSe
Molecular Weight:
228.1729
IUPAC Name:
3-methyl-1,3-benzothiazole-2-selone
InChI:
InChI=1S/C8H7NSSe/c1-9-6-4-2-3-5-7(6)10-8(9)11/h2-5H,1H3
InChI Key:
VBKDUIRAXCKPOA-UHFFFAOYSA-N
SMILES:
Cn1c(=[Se])sc2c1cccc2
EC Number:
220-506-7
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.946g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.182g/mol
Monoisotopic Mass:
228.946g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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