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383142-92-5 | 6-Benzothiazolol,2-(1H-pyrrol-1-yl)-(9CI)
CAS No: 383142-92-5 Catalog No: AG00CPEI MDL No:
Product Description
Catalog Number:
AG00CPEI
Chemical Name:
6-Benzothiazolol,2-(1H-pyrrol-1-yl)-(9CI)
CAS Number:
383142-92-5
IUPAC Name:
2-pyrrol-1-yl-1,3-benzothiazol-6-ol
InChI:
InChI=1S/C11H8N2OS/c14-8-3-4-9-10(7-8)15-11(12-9)13-5-1-2-6-13/h1-7,14H
InChI Key:
IIEKZGDFAAQQOP-UHFFFAOYSA-N
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.036g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
216.258g/mol
Monoisotopic Mass:
216.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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