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Phenyl pentanoate

Phenyl pentanoate structure

CAS No:
20115-23-5
Formula:
C11H14O2
Chemical Name:
Phenyl pentanoate
Synonyms:
Pentanoic acid,phenyl ester;Valeric acid,phenyl ester;Phenyl valerate;Phenyl pentanoate
Categories:
Chemical Reagents > Organic Reagents

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Description

Grey Solid

Phenyl pentanoate Basic Attributes

Molecular Weight：

178.22800

Exact Mass：

178.23

EC Number：

243-521-0

DSSTox ID：

DTXSID50173930

HScode：

2915600000

Characteristics

PSA：

26.30000

XLogP3：

2.78220

Density：

1.009 g/cm3

Boiling Point：

160 °C @ Press: 14 Torr

Flash Point：

95.2ºC

Refractive Index：

1.494

Drug Information

MeSH Entry Terms：

phenyl valerate

Phenyl pentanoate Use and Manufacturing

Labelled intermediate for the synthesis of Ritalinic Acid-d10.

Computed Properties

Molecular Weight:178.23
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:178.099379685
Monoisotopic Mass:178.099379685
Topological Polar Surface Area:26.3
Heavy Atom Count:13
Complexity:148
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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20115-23-5 phenyl pentanoate

CAS No.: 20115-23-5

Grade: Industrial Grade

Content: 95%

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