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116366-87-1

116366-87-1 | 1,3,5-Triazine-2,4-diamine, 6-chloro-N2-[1-(4-chlorophenyl)ethyl]-

CAS No: 116366-87-1 Catalog No: AG000CAY MDL No:

Product Description

Catalog Number:
AG000CAY
Chemical Name:
1,3,5-Triazine-2,4-diamine, 6-chloro-N2-[1-(4-chlorophenyl)ethyl]-
CAS Number:
116366-87-1
Molecular Formula:
C11H11Cl2N5
Molecular Weight:
284.1445
IUPAC Name:
6-chloro-2-N-[1-(4-chlorophenyl)ethyl]-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C11H11Cl2N5/c1-6(7-2-4-8(12)5-3-7)15-11-17-9(13)16-10(14)18-11/h2-6H,1H3,(H3,14,15,16,17,18)
InChI Key:
AKPACHZBMNJVTR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(Nc1nc(N)nc(n1)Cl)C

Properties

Complexity:
260  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.039g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.144g/mol
Monoisotopic Mass:
283.039g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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