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226-06-2 | 7H-Benzo[c]phenothiazine
CAS No: 226-06-2 Catalog No: AG006X96 MDL No:
Product Description
Catalog Number:
AG006X96
Chemical Name:
7H-Benzo[c]phenothiazine
CAS Number:
226-06-2
Molecular Formula:
C16H11NS
Molecular Weight:
249.3302
IUPAC Name:
7H-benzo[c]phenothiazine
InChI:
InChI=1S/C16H11NS/c1-2-6-12-11(5-1)9-10-14-16(12)18-15-8-4-3-7-13(15)17-14/h1-10,17H
InChI Key:
WUTNPRKQMZJXTR-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)Nc1c(S2)c2ccccc2cc1
NSC Number:
1980
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.061g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.331g/mol
Monoisotopic Mass:
249.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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