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1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone

1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone structure

CAS No:
24473-06-1
Formula:
C12H15ClO2
Chemical Name:
1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone
Synonyms:
2-Butanone,1-(4-chlorophenoxy)-3,3-dimethyl-;2-Butanone,1-(p-chlorophenoxy)-3,3-dimethyl-;1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone;1-(4-Chlorophenoxy)-3,3-dimethylbutanone-2

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1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone Basic Attributes

Molecular Weight：

226.6993

Exact Mass：

226.70

EC Number：

607-382-3

DSSTox ID：

DTXSID4051906

HScode：

2914700090

Characteristics

PSA：

26.3

XLogP3：

3.33400

Density：

1.105g/cm3

Boiling Point：

304.1ºC at 760 mmHg

Flash Point：

117.3ºC

Refractive Index：

1.506

Vapor Pressure：

0.000896mmHg at 25°C

Toxicity：

Oral-Rat LD50: 4650 mg/kg; Oral-Mouse LD50: 3900 mg/kg

Flammability characteristics：

Flammable, decomposes toxic chloride gas when burning

Safety Information

Storage features：

Warehouse low temperature, ventilated, dry

Toxicity

Toxicity class：

moderately toxic

1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone Use and Manufacturing

Manufacturing Info：

2-Butanone, 1-(4-chlorophenoxy)-3,3-dimethyl-: INACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:226.70
XLogP3:3.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:226.0760574
Monoisotopic Mass:226.0760574
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:212
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone

Basic Attributes
Characteristics
Safety Information
Toxicity
Use and Manufacturing
Computed Properties

1-(4-Chlorophenoxy)-3,3-dimethyl-2-butanone

SDS

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