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2,3-Dimethylpentanal

2,3-Dimethylpentanal structure

CAS No:
32749-94-3
Formula:
C7H14O
Chemical Name:
2,3-Dimethylpentanal
Synonyms:
Pentanal,2,3-dimethyl-;Valeraldehyde,2,3-dimethyl-;2,3-Dimethylpentanal;2,3-Dimethylvaleraldehyde;NSC 73707;3944-76-1;7492-94-6

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2,3-Dimethylpentanal Basic Attributes

Molecular Weight：

114.18500

Exact Mass：

114.19

EC Number：

251-193-5

NSC Number：

73707

DSSTox ID：

DTXSID1022213

HScode：

2912190090

Characteristics

PSA：

17.07000

XLogP3：

1.86750

Density：

0.803g/cm3

Melting Point：

-110ºC

Boiling Point：

141-142 °C

Flash Point：

58.3ºC

Refractive Index：

1.401

Safety Information

Packing level：

III

Hazard category：

3.2

Transport codes：

UN 1989

hazard class code：

R10

safety instructions：

S16

Fire Hazards：

Flammable - 3rd degree

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P272, P280, P302+P352, P303+P361+P353, P321, P333+P313, P363, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 10 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2,3-Dimethylpentanal Use and Manufacturing

Use Classification：

Fire Hazards -> Flammable - 3rd degree

Computed Properties

Molecular Weight:114.19
XLogP3:2.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:114.104465066
Monoisotopic Mass:114.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:8
Complexity:68.8
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,3-Dimethylpentanal

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

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