3,4-Dichlorobenzenemethanamine
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3,4-Dichlorobenzenemethanamine
structure -
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CAS No:
102-49-8
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Formula:
C7H7Cl2N
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Chemical Name:
3,4-Dichlorobenzenemethanamine
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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
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CAS No:
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
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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