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Quinoclamine

Quinoclamine structure

CAS No:
2797-51-5
Formula:
C10H6ClNO2
Chemical Name:
Quinoclamine
Synonyms:
1,4-Naphthalenedione,2-amino-3-chloro-;1,4-Naphthoquinone,2-amino-3-chloro-;2-Amino-3-chloro-1,4-naphthalenedione;06K;06K50W;2-Amino-3-chloro-1,4-naphthoquinone;2-Chloro-3-amino-1,4-naphthoquinone;06K-Quinone;ACNQ;2-Amino-3-chloronaphthoquinone;ACN;3-Chloro-2-amino-1,4-naphthoquinone;Mogeton;Quinoclamine;NSC 3910;NSC 642009;2-Amino-3-chloro-1,4-dihydronaphthalene-1,4-dione
Categories:
Analytical Chemistry > Standard

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Description

Orange powder

Quinoclamin is a member of 1,4-naphthoquinones.

Quinoclamine Basic Attributes

Molecular Weight：

207.61

Exact Mass：

207.61

EC Number：

220-529-2

UNII：

JN6NK7K14F

NSC Number：

642009|3910

DSSTox ID：

DTXSID1041390

HScode：

2922399021

Characteristics

PSA：

60.2

XLogP3：

1.31

Appearance：

Orange Powder

Density：

1.5±0.1 g/cm3

Melting Point：

199 °C

Boiling Point：

310℃

Flash Point：

141℃

Refractive Index：

1.660

Storage Conditions：

0-6°C

Vapor Pressure：

4.50e-07 mmHg

Toxicity：

Oral-Rat LD50: 1360 mg/kg; Oral-Mouse LD50: 1260 mg/kg

Flammability characteristics：

Combustion produces toxic nitrogen oxides and chloride gases

Safety Information

Hazard category：

6.1

Transport codes：

UN2811 - class 6.1 - PG 3 - EHS - Toxic solids, organic, n.o.s., HI: all

wgk germany：

hazard class code：

36/37/38-23-22-50/53-36

safety instructions：

45-37/39-26-61-60

RTECS Number：

QL7350000

Marks：

T,N

Storage features：

The warehouse is ventilated, low temperature and dry; stored and transported separately from food materials

Precautionary statement(s)：

P261-P273-P305 + P351 + P338-P311

Hazard Statements：

H302-H319-H331-H400

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P260, P261, P264, P270, P271, P272, P273, P280, P281, P301+P312, P302+P352, P304+P340, P305+P351+P338, P308+P313, P309+P311, P311, P321, P330, P333+P313, P337+P313, P363, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 136 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|Warning|H336: May cause drowsiness or dizziness [Warning Specific target organ toxicity, single exposure; Narcotic effects]|P261, P271, P273, P304+P340, P312, P403+P233, P405, and P501

Toxicity

Toxicity class：

moderately toxic

Drug Information

MeSH Entry Terms：

2-chloro-3-amino-1,4-naphthoquinone

Quinoclamine Use and Manufacturing

Use Classification：

Agrochemicals -> Algicides, Herbicides|Algicides, Herbicides|Environmental transformation -> Pesticides (parent, predecessor)

Agrochemical：

Quinoclamine has known environmental transformation products that include 1,4-Dihydroxynaphthalene, AHN, AN, HN, and NQ.

Computed Properties

Molecular Weight:207.61
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:207.0087061
Monoisotopic Mass:207.0087061
Topological Polar Surface Area:60.2
Heavy Atom Count:14
Complexity:335
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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