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1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone

1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone structure

CAS No:
1202-08-0
Formula:
C12H16O
Chemical Name:
1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone
Synonyms:
Ethanone,1-[2-methyl-5-(1-methylethyl)phenyl]-;Acetophenone,5′-isopropyl-2′-methyl-;1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone;2-Acetyl-p-cymene;1-Acetyl-5-isopropyl-2-methylbenzene;NSC 9414;1-(5-Isopropyl-2-methylphenyl)ethanone;1-(5-Isopropyl-2-methylphenyl)ethan-1-one;1-(2-Methyl-5-propan-2-ylphenyl)ethanone;1-[2-Methyl-5-(propan-2-yl)phenyl]ethan-1-one

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1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone Basic Attributes

Molecular Weight：

176.259

Exact Mass：

176.25

EC Number：

214-862-2

UNII：

3YKN12PCEQ

NSC Number：

9414

DSSTox ID：

DTXSID1074468

HScode：

2914399090

Characteristics

PSA：

17.1

XLogP3：

3.32100

Density：

0.9864 g/cm³ @ Temp: 0 °C

Melting Point：

<-20 °C

Boiling Point：

249.5 °C

Flash Point：

97.6ºC

Refractive Index：

1.5181 (estimate)

Vapor Pressure：

0.0222mmHg at 25°C

Computed Properties

Molecular Weight:176.25
XLogP3:3.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:176.120115130
Monoisotopic Mass:176.120115130
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:184
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone

Basic Attributes
Characteristics
Computed Properties

1-[2-Methyl-5-(1-methylethyl)phenyl]ethanone

SDS

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