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5-IODOINDOLE

5-IODOINDOLE structure

CAS No:
16066-91-4
Formula:
C8H6IN
Chemical Name:
5-IODOINDOLE
Synonyms:
5-IODO-1H-INDOLE;5-IODOINDOLE;5-Iodo-1H-indole 97%;5-Indoindole;5-Iodo-1H-indole, 95+%;5-Iodoindole 97%;5-Iodo-1H-indole97%;1H-Indole, 5-iodo-
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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5-IODOINDOLE Basic Attributes

Molecular Weight：

243.04

Exact Mass：

242.95450

DSSTox ID：

DTXSID60382031

HScode：

2933990090

Characteristics

PSA：

15.79000

XLogP3：

2.77250

Density：

1.960±0.06 g/cm3

Melting Point：

101-104 °C (lit.)

Boiling Point：

341.7±15.0 °C(Predicted)

Flash Point：

160.5ºC

Refractive Index：

1.768

Vapor Pressure：

0.000156mmHg at 25°C

PKA：

16.14±0.30

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36-37

Marks：

Precautionary statement(s)：

P261; P305 + P351 + P338

Hazard Statements：

H315; H319; H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:243.04
XLogP3:3
Hydrogen Bond Donor Count:1
Exact Mass:242.95450
Monoisotopic Mass:242.95450
Topological Polar Surface Area:15.8
Heavy Atom Count:10
Complexity:126
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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