4-Chloro-2-fluorobenzoic acid
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4-Chloro-2-fluorobenzoic acid
structure -
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CAS No:
446-30-0
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Formula:
C7H4ClFO2
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Chemical Name:
4-Chloro-2-fluorobenzoic acid
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Synonyms:
Benzoic acid,4-chloro-2-fluoro-;4-Chloro-2-fluorobenzoic acid;NSC 190363;2-Fluoro-4-chlorobenzoic acid
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CAS No:
4-Chloro-2-fluorobenzoic acid Basic Attributes
174.56
174.56
207-162-3
190363
DTXSID60196236
29163990
Characteristics
37.3
2.3
white crystalline powder
1.5±0.1 g/cm3
205 °C
274.7°C at 760 mmHg
119.9±21.8 °C
1.558
H2O: insoluble
0.00259mmHg at 25°C
Safety Information
IRRITANT
NONH for all modes of transport
3
36/37/38-22
26-36-37/39
Xi,Xn
Irritant
P261-P305 + P351 + P338
H315-H319-H335
4-Chloro-2-fluorobenzoic acid Use and Manufacturing
Used as pesticide and pharmaceutical intermediate
Benzoic acid, 4-chloro-2-fluoro-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:174.55
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:173.9883852
Monoisotopic Mass:173.9883852
Topological Polar Surface Area:37.3
Heavy Atom Count:11
Complexity:163
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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