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Heptadecanenitrile

Heptadecanenitrile structure

Heptadecanenitrile 

structure
  • CAS No:

    5399-02-0

  • Formula:

    C17H33N

  • Chemical Name:

    Heptadecanenitrile

  • Synonyms:

    Heptadecanenitrile;Hexadecyl cyanide;Heptadecanonitrile;n-Heptadecanonitrile;NSC 3704

Heptadecanenitrile Basic Attributes

251.45100

251.45

226-432-1

3704

DTXSID1028360

2926909090

Characteristics

23.79000

6.38138

0.831g/cm3

34 °C

349 °C

137.5ºC

1.446

Safety Information

UN 3276

3

22

26-36/37/39

Xn

P264, P273, P280, P302+P352, P321, P332+P313, P362, P391, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory.|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P273, P280, P302+P352, P321, P332+P313, P362, P391, and P501|Aggregated GHS information provided by 36 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Heptadecanenitrile Use and Manufacturing

Heptadecanenitrile: ACTIVE|Nitriles, C16-18: INACTIVE

Computed Properties

Molecular Weight:251.5
XLogP3:7.5
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:14
Exact Mass:251.261300057
Monoisotopic Mass:251.261300057
Topological Polar Surface Area:23.8
Heavy Atom Count:18
Complexity:189
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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