AG002V78

2901-77-1 | Tyrosine, N-acetyl-

AG002V78

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CAS Number	2901-77-1
Catalog Number	AG002V78(AGN-PC-0O8N6Q)
Chemical Name	Tyrosine, N-acetyl-
IUPAC Name	2-acetamido-3-(4-hydroxyphenyl)propanoic acid
InChI	InChI=1S/C11H13NO4/c1-7(13)12-10(11(15)16)6-8-2-4-9(14)5-3-8/h2-5,10,14H,6H2,1H3,(H,12,13)(H,15,16)
InChI Key	CAHKINHBCWCHCF-UHFFFAOYSA-N
MDL Number	MFCD00063038
Molecular Formula	C11H13NO4
Molecular Weight	223.2252
NSC Number	10853
SMILES	O=C(O)C(NC(C)=O)CC1=CC=C(O)C=C1
Synonyms	acetyl-L-tyrosine, N-acetyltyrosine, N-acetyltyrosine, (D)-isomer, N-acetyltyrosine, (DL)-isomer, 2-acetamido-3-(4-hydroxyphenyl)propanoic acid, N-acetyl-DL-tyrosine, 2901-77-1, N-Acetyltyrosine, N-Acetyl-4-hydroxyphenylalanine, NSC10853, L-Tyrosine, N-acetyl-, CHEBI:68561, CAHKINHBCWCHCF-UHFFFAOYSA-N, 2-Acetylamino-3-(4-hydroxy-phenyl)-propionic acid, NSC-10853, ACMC-209la1, Tyrosine, N-acetyl-, L-, Oprea1_187931, MLS004754479, SCHEMBL313539, CHEMBL1972224, CTK8J1236, N-Acetyl-4-hydroxyphenylalanine #, AKOS000130924, AKOS022483808, MCULE-3253015023, NE57501, KS-0000101M, NCGC00186643-01, AK-49872, AS-12638, NCI60_000201, SC-09928, SMR002530024, SY006465, DB-052394, FT-0698177, EN300-94385, MFCD00037190 (95%), AA-516/30012044, alpha-(Acetylamino)-4-hydroxybenzenepropanoic acid, 2-(acetylamino)-3-(4-hydroxyphenyl)propanoic acid, Q27137011, Z1269638416, N-alpha-Acetyl-DL-Tyrosine;(+/-)-2-Acetylamino-3-(4-hydroxyphenyl) propanoic acid, N-Acetyl-L-tyrosine, Ac-Tyr-OH, Tyrosine, L-, AC-D-TYR-OH, ACETYL-L-TYROSINE, AC1L3HDY, AC1Q5SDV, 537-55-3, C11H13NO4, CID89216, AR-1K5843, ACN-026363, (R)-2-Acetamido-3-(4-hydroxyphenyl)propanoic acid, 19764-32-0, I14-0072, (2S)-2-acetamido-3-(4-hydroxyphenyl)propanoic acid, alpha-(Acetamido)-beta-(4-Hydroxyphenyl)-propionic Acid, 36871-69-9, NAT,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.084458g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	223.22g/mol
Monoisotopic Mass	223.084458g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	86.6Ų
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302-H315-H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

Lot Number