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68867-18-5 | 2-Methylbenzo[d]thiazol-6-ol
CAS No: 68867-18-5 Catalog No: AG005NOG MDL No:MFCD00227234
Product Description
Catalog Number:
AG005NOG
Chemical Name:
2-Methylbenzo[d]thiazol-6-ol
CAS Number:
68867-18-5
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
MDL Number:
MFCD00227234
IUPAC Name:
2-methyl-1,3-benzothiazol-6-ol
InChI:
InChI=1S/C8H7NOS/c1-5-9-7-3-2-6(10)4-8(7)11-5/h2-4,10H,1H3
InChI Key:
ROFBPPIQUBJMRO-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)sc(n2)C
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.21g/mol
Monoisotopic Mass:
165.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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