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26278-78-4 | 6-Benzothiazolol, 2-amino-, hydrochloride (1:1)
CAS No: 26278-78-4 Catalog No: AG002SKN MDL No:
Product Description
Catalog Number:
AG002SKN
Chemical Name:
6-Benzothiazolol, 2-amino-, hydrochloride (1:1)
CAS Number:
26278-78-4
Molecular Formula:
C7H7ClN2OS
Molecular Weight:
202.6613
IUPAC Name:
2-amino-1,3-benzothiazol-6-ol;hydrochloride
InChI:
InChI=1S/C7H6N2OS.ClH/c8-7-9-5-2-1-4(10)3-6(5)11-7;/h1-3,10H,(H2,8,9);1H
InChI Key:
VLQGGLVKPGDBAH-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)sc(n2)N.Cl
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.997g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
202.656g/mol
Monoisotopic Mass:
201.997g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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