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TRANS-3-(TRIFLUOROMETHYL)CINNAMOYLCHLORIDE

TRANS-3-(TRIFLUOROMETHYL)CINNAMOYLCHLORIDE structure

CAS No:
64379-91-5
Formula:
C10H6ClF3O
Chemical Name:
TRANS-3-(TRIFLUOROMETHYL)CINNAMOYLCHLORIDE
Synonyms:
TRANS-M-TRIFLUOROMETHYL-CINNAMOYL CHLORIDE;Cinacalcet Impurity 60;(E)-3-[3-(Trifluoromethyl)phenyl]acryloyl chloride, (2E)-3-[3-(Trifluoromethyl)phenyl]prop-2-enoyl chloride, 3-[(1E)-3-Chloro-3-oxoprop-1-en-1-yl]benzotrifluoride;ThreefluorineMethyl cinnaMicacid chloride;TRANS-3-(TRIFLUOROMETHYL)CINNAMOYL CHLORIDE;3-(TRIFLUOROMETHYL)CINNAMOYL CHLORIDE;(E)-3-(3-(Trifluoromethyl)phenyl)acryloyl chloride;2-Propenoyl chloride, 3-[3-(trifluoromethyl)phenyl]-, (2E)-
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Pharmaceutical Intermediates > Bulk Drug Intermediates

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TRANS-3-(TRIFLUOROMETHYL)CINNAMOYLCHLORIDE Basic Attributes

Molecular Weight：

234.6

Exact Mass：

234.0059270

DSSTox ID：

DTXSID40345907

Characteristics

PSA：

17.07000

XLogP3：

3.48400

Density：

1.372 g/mL at 25 °C(lit.)

Melting Point：

28-31℃

Boiling Point：

148 °C60 mm Hg(lit.)

Flash Point：

201 °F

Refractive Index：

n20/D 1.544(lit.)

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3265 8/PG 2

wgk germany：

hazard class code：

34-36/37/38-26

safety instructions：

26-36/37/39-45

Marks：

C,Xn

GHS Classification：

|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 44 companies from 3 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:234.60
XLogP3:3.7
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:234.0059270
Monoisotopic Mass:234.0059270
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Complexity:260
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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trans-3-(Trifluoromethyl)cinnamoyl chloride

CAS No.: 64379-91-5

Content: 99.00%

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Guide of TRANS-3-(TRIFLUOROMETHYL)CINNAMOYLCHLORIDE

Basic Attributes
Characteristics
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