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Home > Encyclopedia > 3,4-Dichlorobenzenemethanamine

3,4-Dichlorobenzenemethanamine

3,4-Dichlorobenzenemethanamine structure

3,4-Dichlorobenzenemethanamine 

structure
  • CAS No:

    102-49-8

  • Formula:

    C7H7Cl2N

  • Chemical Name:

    3,4-Dichlorobenzenemethanamine

  • Synonyms:

    Benzenemethanamine,3,4-dichloro-;Benzylamine,3,4-dichloro-;3,4-Dichlorobenzenemethanamine;3,4-Dichlorobenzylamine;(3,4-Dichlorophenyl)methanamine;((3,4-Dichlorophenyl)methyl)amine;NSC 25065;1-(3,4-Dichlorophenyl)methanamine

  • Categories:

    Organic Chemistry  >  Coordination Complexes

Description

clear colorless to light yellow liquid

3,4-Dichlorobenzenemethanamine Basic Attributes

176.04

176.04

203-035-1

25065

DTXSID9059254

29214990

Characteristics

26

2.5

1.32 g/mL at 25 °C(lit.)

332-333 °C @ Solvent: Dimethylformamide

139-140 °C @ Press: 17 Torr

>230 °F

n 20/D 1.578(lit.)

Safety Information

III

8

UN 2735 8/PG 3

3

R34

23-26-36/37/39-45

C,Xi

P280-P305 + P351 + P338-P310

H314

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

3,4-Dichlorobenzenemethanamine Use and Manufacturing

Methods of Manufacturing

Add 3, 4-dichlorobenzyl azide (5 mmol, 1.01 g) to a 100 mL vial.Solvent dichloromethane (25 mL), N2 protection, A solution of boron tribromide (20 mmol, 5.00 g) in dichloromethane (25 mL) was added dropwise at 0 °C.After the drop, the reaction was carried out at 25 ° C for 6 h.After the reaction was completed, methanol (25 mL) was added and quenched for 0.5 h, the reaction liquid was clarified, and the reaction liquid was directly concentrated by evaporation.Recrystallization from methanol / diethyl ether gave the title product as white.Yield 89percent (0.778 g).

Benzenemethanamine, 3,4-dichloro-: ACTIVE

Computed Properties

Molecular Weight:176.04
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:174.9955546
Monoisotopic Mass:174.9955546
Topological Polar Surface Area:26
Heavy Atom Count:10
Complexity:108
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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