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1365988-34-6 | 4-Chloro-2,6-diaminobenzotrifluoride
CAS No: 1365988-34-6 Catalog No: AG01FDIT MDL No:MFCD21602106
Product Description
Catalog Number:
AG01FDIT
Chemical Name:
4-Chloro-2,6-diaminobenzotrifluoride
CAS Number:
1365988-34-6
Molecular Formula:
C7H6ClF3N2
Molecular Weight:
210.5841
MDL Number:
MFCD21602106
IUPAC Name:
5-chloro-2-(trifluoromethyl)benzene-1,3-diamine
InChI:
InChI=1S/C7H6ClF3N2/c8-3-1-4(12)6(5(13)2-3)7(9,10)11/h1-2H,12-13H2
InChI Key:
BWEDCFBHXDEJGY-UHFFFAOYSA-N
SMILES:
FC(c1c(N)cc(cc1N)Cl)(F)F
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
210.584g/mol
Monoisotopic Mass:
210.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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