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78988-61-1 | 2H-Indeno[5,6-d]thiazole(9CI)
CAS No: 78988-61-1 Catalog No: AG005NSX MDL No:MFCD18814746
Product Description
Catalog Number:
AG005NSX
Chemical Name:
2H-Indeno[5,6-d]thiazole(9CI)
CAS Number:
78988-61-1
Molecular Formula:
C10H7NS
Molecular Weight:
173.2343
MDL Number:
MFCD18814746
IUPAC Name:
2H-cyclopenta[f][1,3]benzothiazole
InChI:
InChI=1S/C10H7NS/c1-2-7-4-9-10(12-6-11-9)5-8(7)3-1/h1-5H,6H2
InChI Key:
HOVRYFCMXQPPDG-UHFFFAOYSA-N
SMILES:
C1Sc2c(=N1)cc1c(=CC=C1)c2
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.03g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.233g/mol
Monoisotopic Mass:
173.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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