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178999-32-1 | 7-Benzothiazolol,2-(1,1-dimethylethyl)-(9CI)
CAS No: 178999-32-1 Catalog No: AG00AUX8 MDL No:
Product Description
Catalog Number:
AG00AUX8
Chemical Name:
7-Benzothiazolol,2-(1,1-dimethylethyl)-(9CI)
CAS Number:
178999-32-1
IUPAC Name:
2-tert-butyl-1,3-benzothiazol-7-ol
InChI:
InChI=1S/C11H13NOS/c1-11(2,3)10-12-7-5-4-6-8(13)9(7)14-10/h4-6,13H,1-3H3
InChI Key:
LZZZLDYALWYBMV-UHFFFAOYSA-N
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.072g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.291g/mol
Monoisotopic Mass:
207.072g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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