4-Hydroxyphenylacetaldehyde
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4-Hydroxyphenylacetaldehyde
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CAS No:
7339-87-9
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Formula:
C8H8O2
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Chemical Name:
4-Hydroxyphenylacetaldehyde
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Synonyms:
Benzeneacetaldehyde,4-hydroxy-;Acetaldehyde,(p-hydroxyphenyl)-;4-Hydroxybenzeneacetaldehyde;(p-Hydroxyphenyl)acetaldehyde;4-Hydroxyphenylacetaldehyde;4-Hydroxyphenylacetadehyde;2-(4-Hydroxyphenyl)acetaldehyde
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CAS No:
Description
Pale Yellow Liquid
Solid
(4-hydroxyphenyl)acetaldehyde is an alpha-CH2-containing aldehyde and a member of phenylacetaldehydes. It has a role as a human metabolite, an Escherichia coli metabolite and a mouse metabolite.
Characteristics
37.30000
1.04
Solid
1.2±0.1 g/cm3
118 °C
281.4±15.0 °C at 760 mmHg
117.9±13.0 °C
1.555
Safety Information
Xi: Irritant;
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, P501
H302
|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 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Drug Information
2-(4-hydroxyphenyl)acetaldehyde is a known human metabolite of astemizole.
4-hydroxyphenylacetaldehyde
4-Hydroxyphenylacetaldehyde Use and Manufacturing
An intermediate in the metabolic pathway in yeast. This compound contains p-Hydroxybenzaldehyde.
Computed Properties
Molecular Weight:136.15
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:136.052429494
Monoisotopic Mass:136.052429494
Topological Polar Surface Area:37.3
Heavy Atom Count:10
Complexity:104
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes