3-(2,4-Dimethoxyphenyl)-2-butenoic acid
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3-(2,4-Dimethoxyphenyl)-2-butenoic acid
structure -
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CAS No:
7706-67-4
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Formula:
C12H14O4
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Chemical Name:
3-(2,4-Dimethoxyphenyl)-2-butenoic acid
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Synonyms:
2-Butenoic acid,3-(2,4-dimethoxyphenyl)-;Cinnamic acid,2,4-dimethoxy-β-methyl-;3-(2,4-Dimethoxyphenyl)-2-butenoic acid;Dimecrotic acid;2,4-Dimethoxy-β-methylcinnamic acid;3-(2,4-Dimethoxyphenyl)crotonic acid
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CAS No:
Characteristics
55.76000
2.80
White crystal powder
1.2±0.1 g/cm3
149 °C
381.2±27.0 °C at 760 mmHg
146.3±17.2 °C
1.538
Safety Information
|Warning|H302 (50%): 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|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:222.24
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:222.08920892
Monoisotopic Mass:222.08920892
Topological Polar Surface Area:55.8
Heavy Atom Count:16
Complexity:272
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(2,4-Dimethoxyphenyl)-2-butenoic acid
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