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3-(3-methylbutyl)pentane-2,4-dione

3-(3-methylbutyl)pentane-2,4-dione structure

CAS No:
10225-31-7
Formula:
C10H18O2
Chemical Name:
3-(3-methylbutyl)pentane-2,4-dione
Synonyms:
Diacetyl-isoamyl-methan; Isoamyl-acetylaceton; 3-Isopentyl-pentan-2,4-dion; 3-isopentyl-pentane-2,4-dione; 3-Isopentyl-2,4-pentanedione; 3-(3-methyl-butyl)-pentane-2,4-dione; 2-Methyl-5-aethanoyl-heptanon-(6); 2,4-Pentanedione,3-isopentyl;Expand

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3-(3-methylbutyl)pentane-2,4-dione Basic Attributes

Molecular Weight：

170.24900

Exact Mass：

170.130679813 g/mol

DSSTox ID：

DTXSID80337003

HScode：

2914190090

Characteristics

PSA：

34.14000

XLogP3：

2.21680

Density：

0.902g/cm3

Boiling Point：

231.8ºC

Flash Point：

84.3ºC

Refractive Index：

1.458

Vapor Pressure：

0.0012mmHg at 25°C

Computed Properties

Molecular Weight:170.25
XLogP3:2.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:170.130679813
Monoisotopic Mass:170.130679813
Topological Polar Surface Area:34.1
Heavy Atom Count:12
Complexity:157
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3-methylbutyl)pentane-2,4-dione

Basic Attributes
Characteristics
Computed Properties

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