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1199943-85-5 |
CAS No: 1199943-85-5 Catalog No: AG01FN07 MDL No:
Product Description
Catalog Number:
AG01FN07
CAS Number:
1199943-85-5
IUPAC Name:
6-bromo-2-ethoxy-1,3-benzothiazole
InChI:
InChI=1S/C9H8BrNOS/c1-2-12-9-11-7-4-3-6(10)5-8(7)13-9/h3-5H,2H2,1H3
InChI Key:
VOCXKNKBOUSOBN-UHFFFAOYSA-N
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.951g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
258.133g/mol
Monoisotopic Mass:
256.951g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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