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9-IODOPHENANTHRENE

9-IODOPHENANTHRENE structure

CAS No:
17024-12-3
Formula:
C14H9I
Chemical Name:
9-IODOPHENANTHRENE
Synonyms:
9-IODOPHENANTHRENE;9-Iodophenanthrene 97%
Categories:
Organic Chemistry > Hydrocarbons and Derivatives

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Description

solid

9-IODOPHENANTHRENE Basic Attributes

Molecular Weight：

304.13

Exact Mass：

303.97500

NSC Number：

89105

DSSTox ID：

DTXSID30293387

HScode：

2903999090

Characteristics

PSA：

XLogP3：

5.1

Density：

1.692±0.06 g/cm3(Predicted)

Melting Point：

91-93 °C(lit.)

Boiling Point：

411.0±14.0 °C(Predicted)

Flash Point：

186.6ºC

Refractive Index：

1.772

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Stability/Shelf Life：

Stable, but light sensitive - store in the dark. Incompatible with strong oxidizing agents.

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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

9-IODOPHENANTHRENE Use and Manufacturing

General procedure: Aryl bromide (10 mmol) was dissolved in dry THF (30 mL) and cooled to -78 °C under anargon atmosphere. n-Butyllithium (1.6 M in n-hexane; 7.5 mL; 12 mmol) was addeddropwise. After 15 minutes a solution of I2 (3.81 g; 15 mmol) in dry THF (10 mL) was addedand the reaction mixture was allowed to warm to room temperature overnight.For workup the reaction mixture was concentrated in vacuo. H2O was added to the residueand it was extracted with DCM (3x). The combined organic phases were washed withsaturated Na2S2O5 solution and H2O. After drying over MgSO4 and concentration underreduced pressure, the crude product was purified by column chromatography.

Computed Properties

Molecular Weight:304.12
XLogP3:5.1
Exact Mass:303.97490
Monoisotopic Mass:303.97490
Heavy Atom Count:15
Complexity:225
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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17024-12-3 9-iodophenanthrene

CAS No.: 17024-12-3

Grade: Industrial Grade

Content: 95%

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