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190384-96-4 | Benzothiazole, 2-[(1,1-dimethylethoxy)methyl]- (9CI)
CAS No: 190384-96-4 Catalog No: AG00AUVX MDL No:
Product Description
Catalog Number:
AG00AUVX
Chemical Name:
Benzothiazole, 2-[(1,1-dimethylethoxy)methyl]- (9CI)
CAS Number:
190384-96-4
IUPAC Name:
2-[(2-methylpropan-2-yl)oxymethyl]-1,3-benzothiazole
InChI:
InChI=1S/C12H15NOS/c1-12(2,3)14-8-11-13-9-6-4-5-7-10(9)15-11/h4-7H,8H2,1-3H3
InChI Key:
WTSMWMZLOKRYNJ-UHFFFAOYSA-N
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.318g/mol
Monoisotopic Mass:
221.087g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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