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184837-06-7 | 6-Benzothiazolol,2-pentyl-(9CI)
CAS No: 184837-06-7 Catalog No: AG00AUZ5 MDL No:
Product Description
Catalog Number:
AG00AUZ5
Chemical Name:
6-Benzothiazolol,2-pentyl-(9CI)
CAS Number:
184837-06-7
IUPAC Name:
2-pentyl-1,3-benzothiazol-6-ol
InChI:
InChI=1S/C12H15NOS/c1-2-3-4-5-12-13-10-7-6-9(14)8-11(10)15-12/h6-8,14H,2-5H2,1H3
InChI Key:
MCPCAFPDQAXXIO-UHFFFAOYSA-N
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.087g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.318g/mol
Monoisotopic Mass:
221.087g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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