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214615-13-1 | 5H-Pyrrolo[2,3-f]benzothiazole,6,7-dihydro-(9CI)
CAS No: 214615-13-1 Catalog No: AG00BTVF MDL No:
Product Description
Catalog Number:
AG00BTVF
Chemical Name:
5H-Pyrrolo[2,3-f]benzothiazole,6,7-dihydro-(9CI)
CAS Number:
214615-13-1
IUPAC Name:
6,7-dihydro-5H-pyrrolo[2,3-f][1,3]benzothiazole
InChI:
InChI=1S/C9H8N2S/c1-2-10-7-4-8-9(3-6(1)7)12-5-11-8/h3-5,10H,1-2H2
InChI Key:
VQMABUWGXKRDET-UHFFFAOYSA-N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.041g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.237g/mol
Monoisotopic Mass:
176.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
53.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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