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(4-Hydroxy-3-methoxyphenyl)acetonitrile

(4-Hydroxy-3-methoxyphenyl)acetonitrile structure

(4-Hydroxy-3-methoxyphenyl)acetonitrile 

structure
  • CAS No:

    4468-59-1

  • Formula:

    C9H9NO2

  • Chemical Name:

    (4-Hydroxy-3-methoxyphenyl)acetonitrile

  • Synonyms:

    Benzeneacetonitrile,4-hydroxy-3-methoxy-;Acetonitrile,(4-hydroxy-3-methoxyphenyl)-;4-Hydroxy-3-methoxybenzeneacetonitrile;Homovanillonitrile;(4-Hydroxy-3-methoxyphenyl)acetonitrile;2-Methoxy-4-(cyanomethyl)phenol;2-(4-Hydroxy-3-methoxyphenyl)acetonitrile

  • Categories:

    Chemical Reagents  >  Organic Reagents

(4-Hydroxy-3-methoxyphenyl)acetonitrile Basic Attributes

163.176

163.17

224-739-5

KBJ5T7NP94

DTXSID00196275

2926909090

Characteristics

53.2

1.46688

1.181g/cm3

56.5 °C

138 °C

153.1ºC

1.554

Safety Information

NONH for all modes of transport

3

R20/21/22

S26-S37/39

Xn: Harmful;Xi: Irritant;

P261-P280-P305 + P351 + P338

H302 + H312 + H332-H315-H319-H335

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 40 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:163.17
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:163.063328530
Monoisotopic Mass:163.063328530
Topological Polar Surface Area:53.2
Heavy Atom Count:12
Complexity:184
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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