5-Chlorosalicylic acid
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5-Chlorosalicylic acid
structure -
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CAS No:
321-14-2
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Formula:
C7H5ClO3
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Chemical Name:
5-Chlorosalicylic acid
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Synonyms:
Benzoic acid,5-chloro-2-hydroxy-;Salicylic acid,5-chloro-;5-Chloro-2-hydroxybenzoic acid;5-Chlorosalicylic acid;2-Hydroxy-5-chlorobenzoic acid;NSC 30111
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CAS No:
Description
OFF-WHITE TO CREAM POWDER
5-chlorosalicylic acid is a monohydroxybenzoic acid that is 2-hydroxybenzoic acid (salicylic acid) in which the hydrogen at position 5 is replaced by chlorine. It is a chlorobenzoic acid, a monohydroxybenzoic acid and a member of monochlorobenzenes. It derives from a benzoic acid. It is a conjugate acid of a 5-chlorosalicylate.
5-Chlorosalicylic acid Basic Attributes
172.57
172.57
206-283-9
J2YFG68VCZ
30111
DTXSID7059806
2918290000
Characteristics
57.5
3.1
white crystalline powder
1.5±0.1 g/cm3
171.5 °C
320.5°C at 760 mmHg
147.6±23.7 °C
1.630
1 g/L (20 ºC)
Store in a cool, dry place. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep containers tightly closed.
LD50 oral in rat: 250mg/kg
Safety Information
III
6.1
UN 2811 6.1/PG 3
3
R22;R36/37/38
S26-S36-S37/39
VO2080000
Xn:Harmful
Stable under normal temperatures and pressures.
P301 + P310-P305 + P351 + P338
H301-H315-H319
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 55 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
5-Chlorosalicylic acid Use and Manufacturing
Moth-proofing, insecticide, intermediate for pharmaceuticals, dyes, pesticides.
Benzoic acid, 5-chloro-2-hydroxy-: ACTIVE
Computed Properties
Molecular Weight:172.56
XLogP3:3.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:171.9927217
Monoisotopic Mass:171.9927217
Topological Polar Surface Area:57.5
Heavy Atom Count:11
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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