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Home > Bromides > 1190316-73-4
1190316-73-4 | 6-Benzothiazolol, 2-bromo-4-methyl-
CAS No: 1190316-73-4 Catalog No: AG000HPV MDL No:
Product Description
Catalog Number:
AG000HPV
Chemical Name:
6-Benzothiazolol, 2-bromo-4-methyl-
CAS Number:
1190316-73-4
Molecular Formula:
C8H6BrNOS
Molecular Weight:
244.1083
IUPAC Name:
2-bromo-4-methyl-1,3-benzothiazol-6-ol
InChI:
InChI=1S/C8H6BrNOS/c1-4-2-5(11)3-6-7(4)10-8(9)12-6/h2-3,11H,1H3
InChI Key:
KNUUBGUGPSSGBJ-UHFFFAOYSA-N
SMILES:
Oc1cc(C)c2c(c1)sc(n2)Br
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.935g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.106g/mol
Monoisotopic Mass:
242.935g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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