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116850-28-3 | Benzene, 2-chloro-1-fluoro-3-methyl-
CAS No: 116850-28-3 Catalog No: AG000D9S MDL No:MFCD08445246
Product Description
Catalog Number:
AG000D9S
Chemical Name:
Benzene, 2-chloro-1-fluoro-3-methyl-
CAS Number:
116850-28-3
Molecular Formula:
C7H6ClF
Molecular Weight:
144.5739
MDL Number:
MFCD08445246
IUPAC Name:
2-chloro-1-fluoro-3-methylbenzene
InChI:
InChI=1S/C7H6ClF/c1-5-3-2-4-6(9)7(5)8/h2-4H,1H3
InChI Key:
YSCFYJSLWLBAND-UHFFFAOYSA-N
SMILES:
Clc1c(C)cccc1F
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.014g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.573g/mol
Monoisotopic Mass:
144.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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