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Pentadecanenitrile

Pentadecanenitrile structure

CAS No:
18300-91-9
Formula:
C15H29N
Chemical Name:
Pentadecanenitrile
Synonyms:
Pentadecanenitrile;Tetradecyl cyanide;1-Tetradecyl cyanide;Pentadecanonitrile

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Pentadecanenitrile Basic Attributes

Molecular Weight：

223.39700

Exact Mass：

223.40

EC Number：

242-184-7

DSSTox ID：

DTXSID50171375

Characteristics

PSA：

23.79000

XLogP3：

5.60118

Density：

0.828g/cm3

Melting Point：

20-23ºC

Boiling Point：

322ºC

Flash Point：

127.5ºC

Refractive Index：

n20/D 1.442(lit.)

Vapor Pressure：

0.0256mmHg at 25°C

Safety Information

Transport codes：

UN 3276 6.1/PG 1

hazard class code：

R20/21/22

safety instructions：

S36

Marks：

GHS Classification：

|Warning|H302 (97.44%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:223.40
XLogP3:6.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:12
Exact Mass:223.229999929
Monoisotopic Mass:223.229999929
Topological Polar Surface Area:23.8
Heavy Atom Count:16
Complexity:166
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Pentadecanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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