AG002AL6

2062-26-2 | 2-Propenoic acid, 3-[4-(trifluoromethyl)phenyl]-

AG002AL6

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CAS Number	2062-26-2
Catalog Number	AG002AL6(AGN-PC-00BZL3)
Chemical Name	2-Propenoic acid, 3-[4-(trifluoromethyl)phenyl]-
IUPAC Name	(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid
InChI	InChI=1S/C10H7F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-6H,(H,14,15)/b6-3+
InChI Key	ANRMAUMHJREENI-ZZXKWVIFSA-N
MDL Number	MFCD00002696
Molecular Formula	C10H7F3O2
Molecular Weight	216.1566
SMILES	O=C(O)C=CC1=CC=C(C(F)(F)F)C=C1
Synonyms	4-(Trifluoromethyl)cinnamic acid, 16642-92-5, trans-4-(Trifluoromethyl)cinnamic acid, p-(Trifluoromethyl)cinnamic acid, (e)-3-(4-(trifluoromethyl)phenyl)acrylic acid, 2062-26-2, 4-Trifluoromethylcinnamic acid, 2-Propenoic acid, 3-[4-(trifluoromethyl)phenyl]-, (2E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid, PTF-CNA, trans-4-Trifluoromethylcinnamic acid, (E)-3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid, 3-(4-trifluoromethyl-phenyl)-acrylic acid, CHEBI:60705, ANRMAUMHJREENI-ZZXKWVIFSA-N, para-(trifluoromethyl)cinnamic acid, MFCD00002696, 3-[4-(TRIFLUOROMETHYL)PHENYL]-2-PROPENOIC ACID, trans-4-(trifluoromethyl)-cinnamic acid, 2-PROPENOIC ACID, 3-[4-(TRIFLUOROMETHYL)PHENYL]-, (2E)-, (2E)-3-(4-trifluoromethylphenyl)acrylic acid, 3-(4-TRIFLUOROMETHYLPHENYL)ACRYLYC ACID, 2-Propenoic acid, 3-(4-(trifluoromethyl)phenyl)-, (E)-3-[4'-(trifluoromethyl)phenyl]-2-propenoic acid, RARECHEM BK HW 0019, (2E)-3-[4-(TRIFLUOROMETHYL)PHENYL]ACRYLIC ACID, (E)-4-(TRIFLUOROMETHYL)CINNAMIC ACID, OTAVA-BB 1512599, TRANS-3-[4-(TRIFLUOROMETHYL)PHENYL]PROP-2-ENOIC ACID, 3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid, 3-[4-(trifluoromethyl)phenyl]acrylic acid, (E)-3-(4-(Trifluoromethyl)phenyl)-2-propenoic acid, (E)-3-[4-(trifluoromethyl)phenyl]-2-propenoic acid, EINECS 218-169-6, PubChem3574, PubChem4365, CL 243236, AC1LEL9Q, AC1Q4JO3, AC1Q71GF, SCHEMBL80570, Jsp004225, CHEMBL1927249, ZINC56575, 4-(trifluoromethyl) cinnamic acid, 4-trifluoromethyl-E-cinnamic acid, HMS1410N11, ACT13059, BCP21449, CS-M0216, ZX-AP004836, BBL035952, CT-087, PC7664, SBB063901, STL444439, trans-4-trifluoromethyl-cinnamic acid, 4-(Trifluoromethyl)benzeneacrylic acid, AKOS000263780, trans-p-(Trifluoromethyl)cinnamic acid, AC-9779, AS00571, AS01927, AS03297, CM13584, PF10989, RP17518, RTR-030754, IDI1_008164, 3-(4-Trifluoromethyl-phenyl)acrylic acid, AJ-09316, DS-14544, SC-01568, SC-39373, AB0011325, AX8000390, RT-002017, TR-030754, ST24032724, ST45255408, EN300-07720, trans-4-(Trifluoromethyl)cinnamic acid, 99%, (E)-3-(4-trifluoromethyl-phenyl)-acrylic acid, C-4547, 642T925, A814750, SR-01000025215, I01-3266, J-010280, J-501905, SR-01000025215-1, (2E)-3-[4-(Trifluoromethyl)phenyl]-2-propenoic acid, Trifluperidol hydrochloride, 2-(Trifluoromethyl)cinnamic acid, C10H7F3O2, AR-1F1100, C10-H7-F3-O2, CID688070, 4-(TRIFLUOROMETHYL)CINNAMICACID, D1224, trans-4-(Trifluoromethyl)cinnamic acid, 98% - 1G 1g, 16952-91-3,

Complexity	250
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	216.04g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.159g/mol
Monoisotopic Mass	216.04g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number