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711017-45-7 | Benzene, 1-(2-bromoethyl)-4-chloro-2-fluoro-
CAS No: 711017-45-7 Catalog No: AG01FAS6 MDL No:
Product Description
Catalog Number:
AG01FAS6
Chemical Name:
Benzene, 1-(2-bromoethyl)-4-chloro-2-fluoro-
CAS Number:
711017-45-7
Molecular Formula:
C8H7BrClF
Molecular Weight:
237.4966
IUPAC Name:
1-(2-bromoethyl)-4-chloro-2-fluorobenzene
InChI:
InChI=1S/C8H7BrClF/c9-4-3-6-1-2-7(10)5-8(6)11/h1-2,5H,3-4H2
InChI Key:
ZMWBJISSSUQJEH-UHFFFAOYSA-N
SMILES:
BrCCc1ccc(cc1F)Cl
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.94g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.496g/mol
Monoisotopic Mass:
235.94g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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