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2,2-DIMETHYL-3-PENTANONE

2,2-DIMETHYL-3-PENTANONE structure

CAS No:
564-04-5
Formula:
C7H14O
Chemical Name:
2,2-DIMETHYL-3-PENTANONE
Synonyms:
NSC244941;t-Butylethylketone;tert-butylethylketone;tert-ButylEthylketone;Ethyltert-butylketone;2,2-DIMETHYL-3-PENTANONE;2,2-DIMETHYLPENTAN-3-ONE;4,4-Dimethyl-3-pentanone;3-Pentanone,2,2-dimethyl-;2,2-Dimethyl-3-oxopentane,Ethyltert-butylketone

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Description

Colorless transparent liquid

2,2-DIMETHYL-3-PENTANONE Basic Attributes

Molecular Weight：

114.188

Exact Mass：

114.10400

NSC Number：

244941

DSSTox ID：

DTXSID10204971

HScode：

2914190090

Characteristics

PSA：

17.1

XLogP3：

2.01160

Density：

0.808 g/cm3

Melting Point：

-45°C

Boiling Point：

128.1ºC at 760 mmHg

Flash Point：

22.4ºC

Refractive Index：

1.403

Safety Information

Precautionary statement(s)：

P264, P280, P305+P351+P338, P33, P313

Hazard Statements：

H319

GHS Classification：

|Warning|H319 (97.44%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:114.19
XLogP3:1.8
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:114.104465066
Monoisotopic Mass:114.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:87.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,2-DIMETHYL-3-PENTANONE

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties

2,2-DIMETHYL-3-PENTANONE

SDS

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