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4-methyl-2-oxopentanal

4-methyl-2-oxopentanal structure

CAS No:
16979-05-8
Formula:
C6H10O2
Chemical Name:
4-methyl-2-oxopentanal
Synonyms:
isobutylglyoxal; 4-methyl-2-oxo-pentanal; Pentanal, 4-methyl-2-oxo-; Pentanal,4-methyl-2-oxo; 4-Methyl-2-oxo-valeraldehyd; 2-Methyl-pentanon-(4)-al-(5);Expand

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4-methyl-2-oxopentanal Basic Attributes

Molecular Weight：

114.14200

Exact Mass：

114.068079557 g/mol

DSSTox ID：

DTXSID70168747

Characteristics

PSA：

34.14000

XLogP3：

0.80050

Density：

0.932g/cm3

Boiling Point：

135.5ºC

Flash Point：

38ºC

Refractive Index：

1.405

Vapor Pressure：

7.7mmHg at 25°C

Computed Properties

Molecular Weight:114.14
XLogP3:0.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:114.068079557
Monoisotopic Mass:114.068079557
Topological Polar Surface Area:34.1
Heavy Atom Count:8
Complexity:94.7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-methyl-2-oxopentanal

Basic Attributes
Characteristics
Computed Properties

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