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Home > Encyclopedia > 6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID

6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID

6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID structure

6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID 

structure
  • CAS No:

    261635-77-2

  • Formula:

    C7H3ClF3NO2

  • Chemical Name:

    6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID

  • Synonyms:

    6-Chloro-4-(trifluoromethyl)nicotinic acid;6-chloro-4-(trifluoromethyl)pyridine-3-carboxylic Acid;6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID;3-Pyridinecarboxylic acid, 6-chloro-4-(trifluoromethyl)-;SCHEMBL1536029;CTK1A1407;KS-00000CUQ;DTXSID30382624;ZINC1529131;2247AB

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

6-CHLORO-4-(TRIFLUOROMETHYL)NICOTINICACID Basic Attributes

225.56

224.98000

DTXSID30382624

2933399090

Characteristics

50.2

2.2

1.603g/cm3

95-105°C

309.9°C at 760 mmHg

141.3ºC

1.496

Safety Information

IRRITANT

Xi

P264, P270, P301+P310, P321, P330, P405, P501

H301

|Danger|H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|Aggregated GHS information provided by 42 companies from 4 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:225.55
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:224.9804405
Monoisotopic Mass:224.9804405
Topological Polar Surface Area:50.2
Heavy Atom Count:14
Complexity:234
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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