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52260-25-0 | Benzothiazole, 2-methyl-, hydrochloride (9CI)
CAS No: 52260-25-0 Catalog No: AG00DO8C MDL No:
Product Description
Catalog Number:
AG00DO8C
Chemical Name:
Benzothiazole, 2-methyl-, hydrochloride (9CI)
CAS Number:
52260-25-0
IUPAC Name:
2-methyl-1,3-benzothiazole;hydrochloride
InChI:
InChI=1S/C8H7NS.ClH/c1-6-9-7-4-2-3-5-8(7)10-6;/h2-5H,1H3;1H
InChI Key:
JESFPXPFYDUKJP-UHFFFAOYSA-N
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.007g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.669g/mol
Monoisotopic Mass:
185.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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