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3,3-dimethyl-1-(2-methylphenyl)butan-1-one

3,3-dimethyl-1-(2-methylphenyl)butan-1-one structure

CAS No:
898785-47-2
Formula:
C13H18O
Chemical Name:
3,3-dimethyl-1-(2-methylphenyl)butan-1-one
Synonyms:
2',3,3-TRIMETHYLBUTYROPHENONE;

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3,3-dimethyl-1-(2-methylphenyl)butan-1-one Basic Attributes

Molecular Weight：

190.28100

Exact Mass：

190.135765193

DSSTox ID：

DTXSID70642375

HScode：

2914399090

Characteristics

PSA：

17.07000

XLogP3：

3.61390

Density：

0.935g/cm3

Boiling Point：

267.8ºC at 760 mmHg

Flash Point：

106.5ºC

Refractive Index：

1.498

Computed Properties

Molecular Weight:190.28
XLogP3:3.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:190.135765193
Monoisotopic Mass:190.135765193
Topological Polar Surface Area:17.1
Heavy Atom Count:14
Complexity:200
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,3-dimethyl-1-(2-methylphenyl)butan-1-one

Basic Attributes
Characteristics
Computed Properties

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