AG003CLL

24435-45-8 | (S)-3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid

AG003CLL

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CAS Number	24435-45-8
Catalog Number	AG003CLL(AGN-PC-0O86RN)
Chemical Name	(S)-3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid
IUPAC Name	(2S)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid
InChI	InChI=1S/C4H5F3O3/c1-3(10,2(8)9)4(5,6)7/h10H,1H3,(H,8,9)/t3-/m0/s1
InChI Key	CTGJACFEVDCYMC-VKHMYHEASA-N
MDL Number	MFCD07375449
Molecular Formula	C4H5F3O3
Molecular Weight	158.0759
SMILES	O=C(O)[C@](C)(O)C(F)(F)F
Synonyms	24435-45-8, (S)-3,3,3-Trifluoro-2-hydroxy-2-methylpropanoic acid, (S)-3,3,3-Trifluoro-2-hydroxy-2-methylpropionic Acid, (2S)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid, (S)-2-Hydroxy-2-(trifluoromethyl)propionic Acid, AK-34318, Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-methyl-, (2S)-, (S)-3,3,3-Trifluoro-2-hydroxyisobutyric Acid, (s)-2-(trifluoromethyl)-2-hydroxypropionic acid, methyl3,3,3-trifluoro-dl-lactate, S-TFM-LA, (2S)-2-Hydroxy-2-methyl-3,3,3-trifluoropropanoic acid, SCHEMBL568924, AMOT0109, CTK3J7068, DTXSID60427057, CTGJACFEVDCYMC-VKHMYHEASA-N, ZINC2556480, ZX-AP010767, 1831AB, ANW-25447, FCH919872, MFCD07375449, PC6419, (S)-TRIFLUOROMETHYLLACTIC ACID, AKOS005063415, AKOS006239564, (S)-alpha-(Trifluoromethyl)lactic acid, EF10179, RP22156, RTR-011290, ACM24435458, AJ-39914, DS-12417, AB1003807, AX8048791, TR-011290, AM20130006, FT-0628496, T1901, (s)-2-hydroxy-2-trifluoro-methylpropionic acid, Y-8820, (2S)-2-Hydroxy-2-(trifluoromethyl)propanoic acid, A817303, 3S107639, 3S210900, I04-0665, (2S)-2-Hydroxy-2-(trifluoromethyl)propanoic acid 95+%, (S)-3,3,3-trifluoro-2-hydroxy-2-methyl-propionic acid, (s)-(-)-3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid, (S)-(-)-3,3,3-trifluoro-2-hydroxy-2-methylpropanoic acid, Propanoic acid, 3,3,3-trifluoro-2-hydroxy-2-methyl-, (2S), (2S)-3,3,3-tris(fluoranyl)-2-methyl-2-oxidanyl-propanoic acid, (S)-3,3,3-TRIFLUORO-2-HYDROXY-2- METHYLPROPIONIC ACID, (S)-3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid, AldrichCPR, (S)-2-Hydroxy-2-(trifluoromethyl)propionic Acid; (S)-3,3,3-Trifluoro-2-hydroxyisobutyric Acid, C4H5F3O3, CID7019028, 3,3,3-trifluoro-2-hydroxy-2-methyl-propanoic Acid,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	158.019g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	158.076g/mol
Monoisotopic Mass	158.019g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	57.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H315-H320-H335
Packing Group	Ⅲ
Precautionary statements	P264-P270-P301+P312-P330
UN Code	UN 1759

Certificate of Analysis

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