3-(2,6-Dichlorophenyl)-2-propenoic acid
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3-(2,6-Dichlorophenyl)-2-propenoic acid
structure -
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CAS No:
5345-89-1
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Formula:
C9H6Cl2O2
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Chemical Name:
3-(2,6-Dichlorophenyl)-2-propenoic acid
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Synonyms:
2-Propenoic acid,3-(2,6-dichlorophenyl)-;Cinnamic acid,2,6-dichloro-;3-(2,6-Dichlorophenyl)-2-propenoic acid;2,6-Dichlorocinnamic acid;NSC 1762
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CAS No:
3-(2,6-Dichlorophenyl)-2-propenoic acid Basic Attributes
217.05
217.05
1953654
226-301-9
1762
2916399090
Characteristics
37.3
3.1
white to light pink powder
1.5±0.1 g/cm3
192-193 °C
355.8°C at 760 mmHg
169.0±23.7 °C
1.638
Safety Information
IRRITANT
37/38
37
UD3333800
Xi
P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, P501
H301
|Danger|H301 (86.36%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 44 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:217.05
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:215.9744848
Monoisotopic Mass:215.9744848
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:206
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(2,6-Dichlorophenyl)-2-propenoic acid
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