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Isovanillyl alcohol

Isovanillyl alcohol structure

Isovanillyl alcohol 

structure
  • CAS No:

    4383-06-6

  • Formula:

    C8H10O3

  • Chemical Name:

    Isovanillyl alcohol

  • Synonyms:

    Benzenemethanol,3-hydroxy-4-methoxy-;Benzyl alcohol,3-hydroxy-4-methoxy-;3-Hydroxy-4-methoxybenzenemethanol;Isovanillyl alcohol;3-Hydroxy-4-methoxybenzyl alcohol;3-Hydroxymethyl-6-methoxyphenol;5-Hydroxymethyl-2-methoxyphenol;NSC 93802

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

White crystalline

Isovanillyl alcohol Basic Attributes

154.163

154.16

224-489-7

93802

DTXSID40195949

2909500000

Characteristics

49.69000

0.7

White crystalline powder

1.2±0.1 g/cm3

136 °C

315.8±27.0 °C at 760 mmHg

144.8±23.7 °C

1.570

Safety Information

NONH for all modes of transport

3

R36/37/38

S22-S24/25

Xi

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:154.16
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:154.062994177
Monoisotopic Mass:154.062994177
Topological Polar Surface Area:49.7
Heavy Atom Count:11
Complexity:116
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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