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5-(Trifluoromethyl)indole

5-(Trifluoromethyl)indole structure

CAS No:
100846-24-0
Formula:
C9H6F3N
Chemical Name:
5-(Trifluoromethyl)indole
Synonyms:
5-(trifluoromethyl)-1H-indole; 5-(Trifluoromethyl)Indole;
Categories:
Inorganic Chemistry > Elementary Substance

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5-(Trifluoromethyl)indole Basic Attributes

Molecular Weight：

185.14600

Exact Mass：

185.04523368

DSSTox ID：

DTXSID30376720

HScode：

2933990090

Characteristics

PSA：

15.79000

XLogP3：

3.18670

Appearance：

WHITE TO TAN TO BROWN SOLID, POWDER

Density：

1.367 g/cm3

Melting Point：

67-69ºC

Boiling Point：

256.7ºC at 760 mmHg

Flash Point：

109ºC

Refractive Index：

1.589

Vapor Pressure：

0.000105mmHg at 25°C

Safety Information

Transport codes：

UN 2811 6.1/PG 3

hazard class code：

R25

safety instructions：

S26

Marks：

Xi; T

Precautionary statement(s)：

P261; P264; P301 + P310; P305 + P351 + P338

Hazard Statements：

H300; H315; H319; H335

GHS Classification：

|Danger|H300 (88.64%): Fatal if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, 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 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:185.15
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:185.04523368
Monoisotopic Mass:185.04523368
Topological Polar Surface Area:15.8
Heavy Atom Count:13
Complexity:190
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5-(Trifluoromethyl)indole

CAS No.: 100846-24-0

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100846-24-0 5-(trifluoromethyl)-1H-indole

CAS No.: 100846-24-0

Grade: Industrial Grade

Content: 95%

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Guide of 5-(Trifluoromethyl)indole

Basic Attributes
Characteristics
Safety Information
Computed Properties
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