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119779-12-3 | Benzene, 1-(2-chloroethyl)-2-fluoro-
CAS No: 119779-12-3 Catalog No: AG000PNC MDL No:MFCD11110026
Product Description
Catalog Number:
AG000PNC
Chemical Name:
Benzene, 1-(2-chloroethyl)-2-fluoro-
CAS Number:
119779-12-3
Molecular Formula:
C8H8ClF
Molecular Weight:
158.6005
MDL Number:
MFCD11110026
IUPAC Name:
1-(2-chloroethyl)-2-fluorobenzene
InChI:
InChI=1S/C8H8ClF/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2
InChI Key:
JVLRUIIRRJELIJ-UHFFFAOYSA-N
SMILES:
ClCCc1ccccc1F
Properties
Complexity:
95.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.03g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.6g/mol
Monoisotopic Mass:
158.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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