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83734-36-5 | 1,3,5-tris(2-chlorophenyl)-1,3,5-triazinane
CAS No: 83734-36-5 Catalog No: AG0055Y7 MDL No:
Product Description
Catalog Number:
AG0055Y7
Chemical Name:
1,3,5-tris(2-chlorophenyl)-1,3,5-triazinane
CAS Number:
83734-36-5
Molecular Formula:
C21H18Cl3N3
Molecular Weight:
418.7467
IUPAC Name:
1,3,5-tris(2-chlorophenyl)-1,3,5-triazinane
InChI:
InChI=1S/C21H18Cl3N3/c22-16-7-1-4-10-19(16)25-13-26(20-11-5-2-8-17(20)23)15-27(14-25)21-12-6-3-9-18(21)24/h1-12H,13-15H2
InChI Key:
HYEGHLWDSBDKLA-UHFFFAOYSA-N
SMILES:
Clc1ccccc1N1CN(CN(C1)c1ccccc1Cl)c1ccccc1Cl
NSC Number:
303553
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.057g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
418.746g/mol
Monoisotopic Mass:
417.057g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
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