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181820-06-4 | 6-Benzothiazolemethanol,alpha-methyl-(9CI)
CAS No: 181820-06-4 Catalog No: AG00AV1Q MDL No:
Product Description
Catalog Number:
AG00AV1Q
Chemical Name:
6-Benzothiazolemethanol,alpha-methyl-(9CI)
CAS Number:
181820-06-4
IUPAC Name:
1-(1,3-benzothiazol-6-yl)ethanol
InChI:
InChI=1S/C9H9NOS/c1-6(11)7-2-3-8-9(4-7)12-5-10-8/h2-6,11H,1H3
InChI Key:
QEVVUCWMTIDBGI-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:
1
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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