Home Halogens 6-(chloromethyl)-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine

6-(chloromethyl)-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine

CAS No.:
105704-32-3
Catalog Number:
AG019OTA
Molecular Formula:
C10H9ClFN5
Molecular Weight:
253.6634
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Product Description
Catalog Number:
AG019OTA
Chemical Name:
6-(chloromethyl)-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine
CAS Number:
105704-32-3
Molecular Formula:
C10H9ClFN5
Molecular Weight:
253.6634
MDL Number:
MFCD03941309
IUPAC Name:
6-(chloromethyl)-2-N-(4-fluorophenyl)-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C10H9ClFN5/c11-5-8-15-9(13)17-10(16-8)14-7-3-1-6(12)2-4-7/h1-4H,5H2,(H3,13,14,15,16,17)
InChI Key:
ZEIVACZLRBMZJI-UHFFFAOYSA-N
SMILES:
ClCc1nc(Nc2ccc(cc2)F)nc(n1)N
Properties
Complexity:
237  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.053g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
253.665g/mol
Monoisotopic Mass:
253.053g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties