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9-Anthracenecarboxylic acid

9-Anthracenecarboxylic acid structure

CAS No:
723-62-6
Formula:
C15H10O2
Chemical Name:
9-Anthracenecarboxylic acid
Synonyms:
9-Anthracenecarboxylic acid;9-Anthroic acid;9-Carboxyanthracene;9-Anthracenylcarboxylic acid;NSC 151909
Categories:
Chemical Reagents > Organic Reagents

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Description

yellow powder

9-anthroic acid is an anthroic acid carrying the carboxy substituent at position 9.

9-Anthracenecarboxylic acid Basic Attributes

Molecular Weight：

222.24

Exact Mass：

222.24

BRN：

1875336

EC Number：

211-964-9

NSC Number：

151909

DSSTox ID：

DTXSID7049427

HScode：

29163900

Characteristics

PSA：

37.3

XLogP3：

3.8

Density：

1.3±0.1 g/cm3

Melting Point：

217 °C (decomp)

Boiling Point：

467.5°C at 760 mmHg

Flash Point：

206.1±14.8 °C

Refractive Index：

1.743

Water Solubility：

H2O: insoluble

Storage Conditions：

Store at RT

Toxicity：

Peritoneal-mouse LD50; 750 mg/kg

Flammability characteristics：

Flammable; burning produces irritating fumes

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38-20/21/22

safety instructions：

37/39-26-36-24/25

RTECS Number：

CB8764000

Marks：

Xi,C,Xn

Storage features：

Warehouse ventilated, low temperature and dry

Hazard note：

Corrosive

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H301

GHS Classification：

|Danger|H301 (14.29%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 10 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Toxicity

Toxicity class：

moderately toxic

Mobility：

549.54 L/kg

Drug Information

Metabolism/Metabolites：

9-Anthracenecarboxylic acid is a known human metabolite of 9-anthraldehyde.

MeSH Entry Terms：

9-AC cpd

9-Anthracenecarboxylic acid Use and Manufacturing

Uses

Used as dye intermediate

Manufacturing Info：

9-Anthracenecarboxylic acid: ACTIVE

Computed Properties

Molecular Weight:222.24
XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:222.068079557
Monoisotopic Mass:222.068079557
Topological Polar Surface Area:37.3
Heavy Atom Count:17
Complexity:277
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 9-Anthracenecarboxylic acid

Description
Basic Attributes
Characteristics
Safety Information
Toxicity
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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9-Anthracenecarboxylic acid

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