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823802-17-1 | 10H-Phenothiazine, 1,3-difluoro-
CAS No: 823802-17-1 Catalog No: AG005397 MDL No:
Product Description
Catalog Number:
AG005397
Chemical Name:
10H-Phenothiazine, 1,3-difluoro-
CAS Number:
823802-17-1
Molecular Formula:
C12H7F2NS
Molecular Weight:
235.2525
IUPAC Name:
1,3-difluoro-10H-phenothiazine
InChI:
InChI=1S/C12H7F2NS/c13-7-5-8(14)12-11(6-7)16-10-4-2-1-3-9(10)15-12/h1-6,15H
InChI Key:
YNMCTIQEKRDRGO-UHFFFAOYSA-N
SMILES:
Fc1cc2Sc3ccccc3Nc2c(c1)F
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.027g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.252g/mol
Monoisotopic Mass:
235.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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