AG0022LL

1810074-80-6 | D-Tyrosine, O-(trifluoromethyl)-, hydrochloride (1:1)

AG0022LL

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CAS Number	1810074-80-6
Catalog Number	AG0022LL(AGN-PC-0WAM94)
Chemical Name	D-Tyrosine, O-(trifluoromethyl)-, hydrochloride (1:1)
IUPAC Name	(2R)-2-amino-3-[4-(trifluoromethoxy)phenyl]propanoic acid;hydrochloride
InChI	InChI=1S/C10H10F3NO3.ClH/c11-10(12,13)17-7-3-1-6(2-4-7)5-8(14)9(15)16;/h1-4,8H,5,14H2,(H,15,16);1H/t8-;/m1./s1
InChI Key	UAKYDNOGIWVOQQ-DDWIOCJRSA-N
MDL Number	MFCD28986153
Molecular Formula	C10H11ClF3NO3
Molecular Weight	285.6474
SMILES	O=C(O)[C@H](N)CC1=CC=C(OC(F)(F)F)C=C1.[H]Cl
Synonyms	1810074-80-6, (R)-2-Amino-3-(4-(trifluoromethoxy)phenyl)propanoic acid hydrochloride, (R)-2-Amino-3-(4-(trifluoromethoxy)phenyl)propanoic acid HCl, SCHEMBL6774234, KS-00000SZY, MFCD28986153, AKOS025395718, GS-7127, KS-000026D8, AX8297079, D-Tyrosine, O-(trifluoromethyl)-, hydrochloride (1:1), (2R)-2-amino-3-[4-(trifluoromethoxy)phenyl]propanoic acid hydrochloride,

Complexity	262
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	285.038g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	285.647g/mol
Monoisotopic Mass	285.038g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	72.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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

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