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27464-38-6 | 2-Benzothiazolesulfinamide,N,N-dimethyl-
CAS No: 27464-38-6 Catalog No: AG007KOA MDL No:
Product Description
Catalog Number:
AG007KOA
Chemical Name:
2-Benzothiazolesulfinamide,N,N-dimethyl-
CAS Number:
27464-38-6
Molecular Formula:
C9H10N2OS2
Molecular Weight:
226.3185
IUPAC Name:
N,N-dimethyl-1,3-benzothiazole-2-sulfinamide
InChI:
InChI=1S/C9H10N2OS2/c1-11(2)14(12)9-10-7-5-3-4-6-8(7)13-9/h3-6H,1-2H3
InChI Key:
FAMTXHDRBMBNAJ-UHFFFAOYSA-N
SMILES:
O=S(c1nc2c(s1)cccc2)N(C)C
EC Number:
248-472-9
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.023g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.312g/mol
Monoisotopic Mass:
226.023g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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