3-(TRIFLUOROMETHOXY)CINNAMIC ACID
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3-(TRIFLUOROMETHOXY)CINNAMIC ACID
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CAS No:
168833-80-5
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Formula:
C10H7F3O3
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Chemical Name:
3-(TRIFLUOROMETHOXY)CINNAMIC ACID
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Synonyms:
3-(TRIFLUOROMETHOXY)CINNAMIC ACID;RARECHEM BK HW 0216;TRANS-3-(TRIFLUOROMETHOXY)CINNAMIC ACID;3-(TRIFLUOROMETHOXY)CINNAMIC ACID, 97%,&;3-(Trifluoromethoxy)cinnamic acid 96%;3-(Trifluoromethoxy)cinnamicacid96%;3-(TRIFLUOROMETHOXY)CINNAMIC ACID 98+%;3-(Trifluoromethoxy)cinnamic acid,99%
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CAS No:
Characteristics
46.5
3.42
off-white crystalline powder
1.403
92-96 °C(lit.)
286℃
127℃
1.527
0.0013mmHg at 25°C
Safety Information
IRRITANT
UN 2811 6.1/PG 3
3
25-36/37/38
26-36-45-26/37/39
T,Xi
Irritant
P261-P301 + P310-P305 + P351 + P338
H301-H315-H319-H335
|Danger|H301 (95%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, 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 40 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:232.16
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:232.03472857
Monoisotopic Mass:232.03472857
Topological Polar Surface Area:46.5
Heavy Atom Count:16
Complexity:273
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-(TRIFLUOROMETHOXY)CINNAMIC ACID
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