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1261733-98-5 | 2-Chloro-3,5-difluorobenzotrifluoride
CAS No: 1261733-98-5 Catalog No: AG01FCZR MDL No:MFCD18415566
Product Description
Catalog Number:
AG01FCZR
Chemical Name:
2-Chloro-3,5-difluorobenzotrifluoride
CAS Number:
1261733-98-5
Molecular Formula:
C7H2ClF5
Molecular Weight:
216.5358
MDL Number:
MFCD18415566
IUPAC Name:
2-chloro-1,5-difluoro-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H2ClF5/c8-6-4(7(11,12)13)1-3(9)2-5(6)10/h1-2H
InChI Key:
YAOBMQFGHMUUBG-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c(c(c1)C(F)(F)F)Cl
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:
3.8
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