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7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLICACID

7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLICACID structure

CAS No:
883541-39-7
Formula:
C10H6F3NO
Chemical Name:
7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLICACID
Synonyms:
7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLIC ACID;1H-Indole-2-carboxaldehyde, 7-(trifluoromethyl)-

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7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLICACID Basic Attributes

Molecular Weight：

213.16

Exact Mass：

229.03506292

DSSTox ID：

DTXSID50405627

HScode：

2933990090

Characteristics

PSA：

53.09000

XLogP3：

2.88490

Safety Information

Hazard category：

IRRITANT

hazard class code：

safety instructions：

Marks：

Xi,T

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:229.15
XLogP3:2.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:229.03506292
Monoisotopic Mass:229.03506292
Topological Polar Surface Area:53.1
Heavy Atom Count:16
Complexity:292
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-(TRIFLUOROMETHYL)-1H-INDOLE-2-CARBOXYLICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

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