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657-05-6 | 2-CHLORO-5-(TRIFLUOROMETHYL)BENZOYL CHLORIDE
CAS No: 657-05-6 Catalog No: AG003GY6 MDL No:MFCD01631634
Product Description
Catalog Number:
AG003GY6
Chemical Name:
2-CHLORO-5-(TRIFLUOROMETHYL)BENZOYL CHLORIDE
CAS Number:
657-05-6
Molecular Formula:
C8H3Cl2F3O
Molecular Weight:
243.0100
MDL Number:
MFCD01631634
IUPAC Name:
2-chloro-5-(trifluoromethyl)benzoyl chloride
InChI:
InChI=1S/C8H3Cl2F3O/c9-6-2-1-4(8(11,12)13)3-5(6)7(10)14/h1-3H
InChI Key:
FRARPACTAFPNNL-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(ccc1Cl)C(F)(F)F
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.951g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.006g/mol
Monoisotopic Mass:
241.951g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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