3-Chloroisonicotinic acid
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3-Chloroisonicotinic acid
structure -
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CAS No:
88912-27-0
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Formula:
C6H4ClNO2
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Chemical Name:
3-Chloroisonicotinic acid
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Synonyms:
3-CHLOROISONICOTINIC ACID;3-CHLOROPYRIDINE-4-CARBOXYLIC ACID;3-CHLORO-4-PYRIDINECARBOXYLIC ACID;3-Chloro-4-pyridine carboxlic acid;3-Chloro-4-pyridinecarboxylicacid,3-Chloroisonicotinicacid;4-Pyridinecarboxylic acid, 3-chloro-;3-Chloropyridine-4-carboxylic acid, 4-Carboxy-3-chloropyridine;3- chlorineisonicotinic acid
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CAS No:
Characteristics
50.2
1
Brown to dark green to black Solution
1.5±0.1 g/cm3
227-231 °C (dec.)(lit.)
387ºC at 760 mmHg
187.8±22.3 °C
1.590
Safety Information
IRRITANT
NONH for all modes of transport
3
22
36
Xn,Xi
Irritant
P305 + P351 + P338
H302-H319
|Warning|H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501|Aggregated GHS information provided by 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:157.55
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:156.9930561
Monoisotopic Mass:156.9930561
Topological Polar Surface Area:50.2
Heavy Atom Count:10
Complexity:140
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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