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Home > Encyclopedia > 3′,4′,5′-Trimethoxyacetophenone

3′,4′,5′-Trimethoxyacetophenone

3′,4′,5′-Trimethoxyacetophenone structure

3′,4′,5′-Trimethoxyacetophenone 

structure
  • CAS No:

    1136-86-3

  • Formula:

    C11H14O4

  • Chemical Name:

    3′,4′,5′-Trimethoxyacetophenone

  • Synonyms:

    Ethanone,1-(3,4,5-trimethoxyphenyl)-;Acetophenone,3′,4′,5′-trimethoxy-;1-(3,4,5-Trimethoxyphenyl)ethanone;3′,4′,5′-Trimethoxyacetophenone;3,4,5-Trimethoxyphenyl methyl ketone;1-(3,4,5-Trimethoxyphenyl)-1-ethanone;Methyl 3,4,5-trimethoxyphenyl ketone;NSC 30099

Description

white to yellow crystalline powderChEBI: A member of the class of acetophenones that is acetophenone substituted by methoxy groups at positions 3, 4 and 5 respectively.


3,4,5-trimethoxyacetophenone is a member of the class of acetophenones that is acetophenone substituted by methoxy groups at positions 3, 4 and 5 respectively. It is a member of acetophenones and a member of methoxybenzenes. It derives from an acetophenone.

3′,4′,5′-Trimethoxyacetophenone Basic Attributes

210.229

210.23

214-501-9

35KU75558G

30099

DTXSID30150481

2914509090

Characteristics

44.8

1.2

white crystals.

1.1922 (rough estimate)

72 °C

132-134 °C @ Press: 1 Torr

173-174°C/10mm

1.5075 (estimate)

Slightly soluble in water.

0.000361mmHg at 25°C

Safety Information

NONH for all modes of transport

3

R34

22-24/25-45-36/37/39-27-26

C

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, 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+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Drug Information

3',4',5'-TMA

Computed Properties

Molecular Weight:210.23
XLogP3:1.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:210.08920892
Monoisotopic Mass:210.08920892
Topological Polar Surface Area:44.8
Heavy Atom Count:15
Complexity:203
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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