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412311-70-7 | Benzothiazole, 2-methoxy-6-methyl- (9CI)
CAS No: 412311-70-7 Catalog No: AG00CPKU MDL No:
Product Description
Catalog Number:
AG00CPKU
Chemical Name:
Benzothiazole, 2-methoxy-6-methyl- (9CI)
CAS Number:
412311-70-7
IUPAC Name:
2-methoxy-6-methyl-1,3-benzothiazole
InChI:
InChI=1S/C9H9NOS/c1-6-3-4-7-8(5-6)12-9(10-7)11-2/h3-5H,1-2H3
InChI Key:
IUBOIPCTUSFSSO-UHFFFAOYSA-N
Properties
Complexity:
165
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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