3-Methoxycinnamic acid
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3-Methoxycinnamic acid
structure -
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CAS No:
6099-04-3
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Formula:
C10H10O3
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Chemical Name:
3-Methoxycinnamic acid
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Synonyms:
2-Propenoic acid,3-(3-methoxyphenyl)-;Cinnamic acid,m-methoxy-;3-(3-Methoxyphenyl)-2-propenoic acid;m-Methoxycinnamic acid;3-Methoxycinnamic acid;3-(3-Methoxyphenyl)acrylic acid;NSC 5234
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CAS No:
Characteristics
46.53000
2.1
White to light brown fine crystalline powder
1.2±0.1 g/cm3
100 °C
329.9±17.0 °C at 760 mmHg
132.6±14.4 °C
1.591
Safety Information
NONH for all modes of transport
3
36/37/38
26-36
Xi
Irritant
P261-P305 + P351 + P338
H315-H319-H335
|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 43 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:178.18
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:178.062994177
Monoisotopic Mass:178.062994177
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:198
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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