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1-Phenyl-3-pentanone

1-Phenyl-3-pentanone structure

CAS No:
20795-51-1
Formula:
C11H14O
Chemical Name:
1-Phenyl-3-pentanone
Synonyms:
3-Pentanone,1-phenyl-;1-Phenyl-3-pentanone;Ethyl phenethyl ketone
Categories:
Chemical Reagents > Organic Reagents

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1-Phenyl-3-pentanone Basic Attributes

Molecular Weight：

162.22800

Exact Mass：

162.23

EC Number：

244-045-6

UNII：

VEP8CR4F7Z

DSSTox ID：

DTXSID10174882

HScode：

2914399090

Characteristics

PSA：

17.07000

XLogP3：

2.59830

Density：

0.96g/cm3

Boiling Point：

124 °C @ Press: 14 Torr

Flash Point：

102.7ºC

Refractive Index：

1.5

Vapor Pressure：

0.034mmHg at 25°C

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:162.23
XLogP3:2.3
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:162.104465066
Monoisotopic Mass:162.104465066
Topological Polar Surface Area:17.1
Heavy Atom Count:12
Complexity:134
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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20795-51-1 1-phenylpentan-3-one

CAS No.: 20795-51-1

Grade: Industrial Grade

Content: 95%

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