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4-Chloroindan-1-one

4-Chloroindan-1-one structure

CAS No:
15115-59-0
Formula:
C9H7ClO
Chemical Name:
4-Chloroindan-1-one
Synonyms:
1H-Inden-1-one,4-chloro-2,3-dihydro-;1-Indanone,4-chloro-;4-Chloro-2,3-dihydro-1H-inden-1-one;4-Chloroindan-1-one;4-Chloroindanone
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Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

White to yellow crystal or oil

4-Chloroindan-1-one Basic Attributes

Molecular Weight：

166.60428

Exact Mass：

166.60

DSSTox ID：

DTXSID40462582

HScode：

2914700090

Characteristics

PSA：

17.1

XLogP3：

2.3

Appearance：

White to yellow crystal or oil

Density：

1.312±0.06 g/cm3(Predicted)

Melting Point：

89-90 °C

Boiling Point：

285.8±29.0 °C(Predicted)

Flash Point：

128.3±15.4 °C

Refractive Index：

1.600

Vapor Pressure：

0.00274mmHg at 25°C

Safety Information

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

4-Chloroindan-1-one Use and Manufacturing

General Procedure D for the Synthesis of Fluoroethyl Substituted Indan Ureas: To a solution of 3-(substituted-phenyl)-propionic acid in CHa solution of 16 g of bromine in 45 ml of acetic acid is added dropwise over 30 minutes at a temperature close to 20 C. to a suspension of 17.5 g of

Computed Properties

Molecular Weight:166.60
XLogP3:2.3
Hydrogen Bond Acceptor Count:1
Exact Mass:166.0185425
Monoisotopic Mass:166.0185425
Topological Polar Surface Area:17.1
Heavy Atom Count:11
Complexity:178
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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4-Chloro-1-indanone

CAS No.: 15115-59-0

Content: 99.00%

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CAS No.: 15115-59-0

Grade: Pharmaceutical Grade

Content: 99%

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