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4-Carboxy-3,5-dichlorobenzotrifluoride

4-Carboxy-3,5-dichlorobenzotrifluoride structure

CAS No:
189338-32-7
Formula:
C8H3Cl2F3O2
Chemical Name:
4-Carboxy-3,5-dichlorobenzotrifluoride
Synonyms:
2,6-dichloro-4-(trifluoromethyl)benzoic Acid;Benzoic acid, 2,6-dichloro-4-(trifluoromethyl)-;SCHEMBL320103;CTK7I6268;DTXSID70470519;9869AA;9870AA;ZINC32628325;AKOS016011454;MCULE-7662762081

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4-Carboxy-3,5-dichlorobenzotrifluoride Basic Attributes

Molecular Weight：

259.0094296

Exact Mass：

257.94600

DSSTox ID：

DTXSID70470519

Characteristics

PSA：

37.3

XLogP3：

3.71040

Boiling Point：

266.242ºC at 760 mmHg

Flash Point：

114.819ºC

Refractive Index：

1.514

Vapor Pressure：

0.004mmHg at 25°C

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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:259.01
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:257.9462192
Monoisotopic Mass:257.9462192
Topological Polar Surface Area:37.3
Heavy Atom Count:15
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Carboxy-3,5-dichlorobenzotrifluoride

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-Carboxy-3,5-dichlorobenzotrifluoride

SDS

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