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16783-35-0 | 7H-Phenaleno[1,2-d]thiazol-7-one
CAS No: 16783-35-0 Catalog No: AG001XN5 MDL No:
Product Description
Catalog Number:
AG001XN5
Chemical Name:
7H-Phenaleno[1,2-d]thiazol-7-one
CAS Number:
16783-35-0
Molecular Formula:
C14H7NOS
Molecular Weight:
237.2765
IUPAC Name:
phenaleno[1,2-d][1,3]thiazol-7-one
InChI:
InChI=1S/C14H7NOS/c16-13-10-6-2-4-8-3-1-5-9(11(8)10)12-14(13)17-7-15-12/h1-7H
InChI Key:
YZMJMJIMRXRPRO-UHFFFAOYSA-N
SMILES:
O=C1c2scnc2c2c3c1cccc3ccc2
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.025g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.276g/mol
Monoisotopic Mass:
237.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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