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89032-05-3 | Benzene, 4-chloro-1-ethyl-2-(trifluoromethyl)-
CAS No: 89032-05-3 Catalog No: AG0042Q6 MDL No:
Product Description
Catalog Number:
AG0042Q6
Chemical Name:
Benzene, 4-chloro-1-ethyl-2-(trifluoromethyl)-
CAS Number:
89032-05-3
Molecular Formula:
C9H8ClF3
Molecular Weight:
208.6080
IUPAC Name:
4-chloro-1-ethyl-2-(trifluoromethyl)benzene
InChI:
InChI=1S/C9H8ClF3/c1-2-6-3-4-7(10)5-8(6)9(11,12)13/h3-5H,2H2,1H3
InChI Key:
ARUADIFCIALQIP-UHFFFAOYSA-N
SMILES:
CCc1ccc(cc1C(F)(F)F)Cl
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.027g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.608g/mol
Monoisotopic Mass:
208.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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