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2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylicacid

2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylicacid structure

CAS No:
306960-80-5
Formula:
C6H2ClF3N2O2
Chemical Name:
2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylicacid
Synonyms:
2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylic acid;2-Chloro-6-(trifluoromethyl)-4-pyrimidinecarboxylic Acid;2-chloro-4-trifluoromethylpyrimidine-6-carboxylic acid;4-Pyrimidinecarboxylic acid, 2-chloro-6-(trifluoromethyl)-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylicacid Basic Attributes

Molecular Weight：

226.54

Exact Mass：

225.9756895

EC Number：

604-604-1

Characteristics

Density：

1.692±0.06 g/cm3

Boiling Point：

375.2±42.0 °C(Predicted)

PKA：

2.01±0.10

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, 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 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:226.54
XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:1
Exact Mass:225.9756895
Monoisotopic Mass:225.9756895
Topological Polar Surface Area:63.1
Heavy Atom Count:14
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylic acid KEK

CAS No.: 306960-80-5

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Guide of 2-Chloro-6-pentafluoroethyl-pyrimidine-4-carboxylicacid

Basic Attributes
Characteristics
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