4-CHLORO-3-FLUOROPHENYLACETIC ACID


Chemical Name: 4-CHLORO-3-FLUOROPHENYLACETIC ACID
CAS Number: 883500-51-4
Product Number: AG00GSEH(AGN-PC-0L0GI9)
Synonyms:
MDL No:
Molecular Formula: C8H6ClFO2
Molecular Weight: 188.5834

Identification/Properties


Computed Properties
Molecular Weight:
188.582g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
188.004g/mol
Monoisotopic Mass:
188.004g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
174
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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