AG002DBJ

201292-99-1 | L-Tyrosine, N-acetyl-O-(1,1-dimethylethyl)-

AG002DBJ

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CAS Number	201292-99-1
Catalog Number	AG002DBJ(AGN-PC-0O73MV)
Chemical Name	L-Tyrosine, N-acetyl-O-(1,1-dimethylethyl)-
IUPAC Name	(2S)-2-acetamido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid
InChI	InChI=1S/C15H21NO4/c1-10(17)16-13(14(18)19)9-11-5-7-12(8-6-11)20-15(2,3)4/h5-8,13H,9H2,1-4H3,(H,16,17)(H,18,19)/t13-/m0/s1
InChI Key	JLNUTWJSFBIAAS-ZDUSSCGKSA-N
MDL Number	MFCD00236772
Molecular Formula	C15H21NO4
Molecular Weight	279.3315
SMILES	O=C(O)[C@@H](NC(C)=O)CC1=CC=C(OC(C)(C)C)C=C1
Synonyms	AC-TYR(TBU)-OH, 201292-99-1, L-Tyrosine,N-acetyl-O-(1,1-dimethylethyl)-, AK170221, Acetyl-O-tert-butyl-L-tyrosine, KS-00000SYU, ZINC2560350, MFCD00236772, AKOS025289465, DS-7554, ACM201292991, FT-0697958, V4165, K-5886, L-Tyrosine, N-acetyl-O-(1,1-dimethylethyl)-, AC-TYR -OH, C15H21NO4, ACN-033700, CID7019616, (2S)-2-acetamido-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic Acid,

Complexity	340
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	279.147g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	279.336g/mol
Monoisotopic Mass	279.147g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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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