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1261535-74-3 | 2-Chloro-4,6-difluorobenzotrifluoride
CAS No: 1261535-74-3 Catalog No: AG01FCZQ MDL No:MFCD18379795
Product Description
Catalog Number:
AG01FCZQ
Chemical Name:
2-Chloro-4,6-difluorobenzotrifluoride
CAS Number:
1261535-74-3
Molecular Formula:
C7H2ClF5
Molecular Weight:
216.5358
MDL Number:
MFCD18379795
IUPAC Name:
1-chloro-3,5-difluoro-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2ClF5/c8-4-1-3(9)2-5(10)6(4)7(11,12)13/h1-2H
InChI Key:
WIJOUVRWUGTVJU-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c(c(c1)Cl)C(F)(F)F
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.977g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.535g/mol
Monoisotopic Mass:
215.977g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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