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1260657-04-2 | Benzene, 2-chloro-1-(2-chloroethyl)-4-fluoro-
CAS No: 1260657-04-2 Catalog No: AG000QYX MDL No:
Product Description
Catalog Number:
AG000QYX
Chemical Name:
Benzene, 2-chloro-1-(2-chloroethyl)-4-fluoro-
CAS Number:
1260657-04-2
Molecular Formula:
C8H7Cl2F
Molecular Weight:
193.0456
IUPAC Name:
2-chloro-1-(2-chloroethyl)-4-fluorobenzene
InChI:
InChI=1S/C8H7Cl2F/c9-4-3-6-1-2-7(11)5-8(6)10/h1-2,5H,3-4H2
InChI Key:
MHHYBAPCJSFQRU-UHFFFAOYSA-N
SMILES:
ClCCc1ccc(cc1Cl)F
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.991g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.042g/mol
Monoisotopic Mass:
191.991g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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