3-(2,3-Dimethoxyphenyl)-2-propenoic acid
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3-(2,3-Dimethoxyphenyl)-2-propenoic acid
structure -
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CAS No:
7461-60-1
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Formula:
C11H12O4
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Chemical Name:
3-(2,3-Dimethoxyphenyl)-2-propenoic acid
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Synonyms:
2-Propenoic acid,3-(2,3-dimethoxyphenyl)-;Cinnamic acid,2,3-dimethoxy-;3-(2,3-Dimethoxyphenyl)-2-propenoic acid;2,3-Dimethoxycinnamic acid;NSC 235795;NSC 403612
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CAS No:
Safety Information
IRRITANT
3
R24/25
24/25
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:208.21
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:208.07355886
Monoisotopic Mass:208.07355886
Topological Polar Surface Area:55.8
Heavy Atom Count:15
Complexity:237
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(2,3-Dimethoxyphenyl)-2-propenoic acid
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