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100124-96-7 | Phenazine, 1,1,4-trichloro-1,2,3,4-tetrahydro-
CAS No: 100124-96-7 Catalog No: AG00010Q MDL No:
Product Description
Catalog Number:
AG00010Q
Chemical Name:
Phenazine, 1,1,4-trichloro-1,2,3,4-tetrahydro-
CAS Number:
100124-96-7
Molecular Formula:
C12H9Cl3N2
Molecular Weight:
287.5723
IUPAC Name:
1,4,4-trichloro-2,3-dihydro-1H-phenazine
InChI:
InChI=1S/C12H9Cl3N2/c13-7-5-6-12(14,15)11-10(7)16-8-3-1-2-4-9(8)17-11/h1-4,7H,5-6H2
InChI Key:
SGLWNQVVHMRNJD-UHFFFAOYSA-N
SMILES:
ClC1CCC(c2c1nc1ccccc1n2)(Cl)Cl
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.983g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.568g/mol
Monoisotopic Mass:
285.983g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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