(2E)-3-(2-Thienyl)-2-propenoic acid
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(2E)-3-(2-Thienyl)-2-propenoic acid
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CAS No:
15690-25-2
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Formula:
C7H6O2S
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Chemical Name:
(2E)-3-(2-Thienyl)-2-propenoic acid
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Synonyms:
2-Propenoic acid,3-(2-thienyl)-,(2E)-;2-Thiopheneacrylic acid,(E)-;2-Propenoic acid,3-(2-thienyl)-,(E)-;(2E)-3-(2-Thienyl)-2-propenoic acid;(E)-3-(2-Thienyl)acrylic acid;(E)-3-(Thiophen-2-yl)acrylic acid;trans-3-Thiopheneacrylic acid;(E)-3-(Thiophen-2-yl)-2-propenoic acid;(2E)-3-(2-Thiophenyl)-2-propenoic acid;trans-3-(2-Thienyl)acrylic acid;trans-3-(2-Thienyl)-2-propenoic acid;(E)-3-(Thien-2-yl)acrylic acid
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CAS No:
(2E)-3-(2-Thienyl)-2-propenoic acid Basic Attributes
154.18634
154.19
112053
214-402-0
INO5ATY68D
4247
Characteristics
65.54000
1.84590
slightly beige powder
1.2950 (rough estimate)
146-148 °C
298.9ºC at 760 mmHg
134.6ºC
1.5100 (estimate)
0.000551mmHg at 25°C
Safety Information
IRRITANT
3
36/37/38
26-36/37
Xi
Irritant
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501
H302
|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 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.|H302 (20%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 5 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:154.19
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:154.00885060
Monoisotopic Mass:154.00885060
Topological Polar Surface Area:65.5
Heavy Atom Count:10
Complexity:154
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(2E)-3-(2-Thienyl)-2-propenoic acid
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