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(-)-Cocaine hydrochloride

(-)-Cocaine hydrochloride structure

CAS No:
53-21-4
Formula:
C17H21NO4.ClH
Chemical Name:
(-)-Cocaine hydrochloride
Synonyms:
8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(benzoyloxy)-8-methyl-,methyl ester,hydrochloride (1:1),(1R,2R,3S,5S)-;1αH,5αH-Tropane-2β-carboxylic acid,3β-hydroxy-,methyl ester,benzoate (ester),hydrochloride;8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(benzoyloxy)-8-methyl-,methyl ester,hydrochloride,[1R-(exo,exo)]-;8-Azabicyclo[3.2.1]octane-2-carboxylic acid,3-(benzoyloxy)-8-methyl-,methyl ester,hydrochloride,(1R,2R,3S,5S)-;Cocaine hydrochloride;Cocaine muriate;(-)-Cocaine hydrochloride;Cocaine chloride;l-Cocaine hydrochloride;Sal de Merck;NIH 8211;MCV 4526;NSC 25263;16205-09-7
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

White Solid

(-)-Cocaine hydrochloride Basic Attributes

Molecular Weight：

339.81400

Exact Mass：

339.12400

EC Number：

200-167-1

NSC Number：

25263

DSSTox ID：

DTXSID2048903

HScode：

2939710000

Characteristics

PSA：

55.84000

XLogP3：

2.60760

Melting Point：

290 °C (decomp)

Boiling Point：

395.2ºC at 760mmHg

Flash Point：

192.8ºC

Safety Information

Packing level：

Hazard category：

6.1(a)

Transport codes：

UN 1544 6.1/PG 3

wgk germany：

hazard class code：

R60

safety instructions：

7-16-36/37-45-22-53

RTECS Number：

YM3050000

Marks：

T,F

Precautionary statement(s)：

P210-P260-P280-P301 + P310-P311

Hazard Statements：

H225-H301-H311-H331-H370

(-)-Cocaine hydrochloride Use and Manufacturing

Inhibits the dopamine, norepinephrine, and serotonin transporters. Unlike amphetamines, it has no effect on catecholamine release. Controlled substance. Anesthetic (local)

Computed Properties

Molecular Weight:339.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:339.1237359
Monoisotopic Mass:339.1237359
Topological Polar Surface Area:55.8
Heavy Atom Count:23
Complexity:432
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of (-)-Cocaine hydrochloride

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Latest News
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(-)-Cocaine hydrochloride

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