AG0028TE

203302-97-0 | 3-(Trifluoromethoxy)phenylacetic acid

AG0028TE

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CAS Number	203302-97-0
Catalog Number	AG0028TE(AGN-PC-0KKY5B)
Chemical Name	3-(Trifluoromethoxy)phenylacetic acid
IUPAC Name	2-[3-(trifluoromethoxy)phenyl]acetic acid
InChI	InChI=1S/C9H7F3O3/c10-9(11,12)15-7-3-1-2-6(4-7)5-8(13)14/h1-4H,5H2,(H,13,14)
InChI Key	NFZQVADYFXRRPM-UHFFFAOYSA-N
MDL Number	MFCD00082480
Molecular Formula	C9H7F3O3
Molecular Weight	220.1453
SMILES	O=C(O)CC1=CC=CC(OC(F)(F)F)=C1
Synonyms	3-(Trifluoromethoxy)phenylacetic Acid, 203302-97-0, 3-Trifluoromethoxyphenylacetic acid, 2-[3-(trifluoromethoxy)phenyl]acetic Acid, 2-(3-(trifluoromethoxy)phenyl)acetic acid, Benzeneacetic acid, 3-(trifluoromethoxy)-, MFCD00082480, 3-Trifluoromethoxyphenylaceticacid, 3-(Trifluoromethoxy)phenylaceticAcid, PubChem4221, AC1MCRMF, ACMC-209f8q, KSC497I5D, SCHEMBL761677, RARECHEM AL BO 0629, CTK3J7451, DTXSID90380469, NFZQVADYFXRRPM-UHFFFAOYSA-N, ACT01191, ALBB-021665, JRD-0661, KS-00000CR1, ZINC2572150, (3-trifluoromethoxyphenyl)acetic acid, ANW-24024, CT-176, SBB064358, WT1672, 3-(trifluoromethoxy)-phenylacetic acid, 3-(Trifluoromethoxy)benzeneacetic acid, AKOS005254293, AC-4199, AM62274, AN-6256, AS01982, CM13753, MCULE-1266687284, PS-7873, RTR-009467, TRA0000690, VZ26140, (3-trifluoromethoxy-phenyl)-acetic acid, [3-(trifluoromethoxy)phenyl]acetic acid, AJ-41968, AK-34007, BR-34007, SC-54196, SY016865, 3-(Trifluoromethoxy)phenylacetic acid 98%, AB0029993, DB-021761, ST2404853, TR-009467, CS-0020102, FT-0643896, ST50407343, X2168, MFCD00082480 (97%), C-5090, 203302-97-0 3-trifluoromethoxyphenylacetic acid, 3-(trifluoromethoxy)phenylacetic acid, AldrichCPR, I01-4692, Z1739254654, C9H7F3O3, ACN-050232, CID2777316, T2406, 3-(Trifluoromethoxy)phenylacetic acid, 98% - 1G 1g, 110102-86-8,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.035g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	220.147g/mol
Monoisotopic Mass	220.035g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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