AG003SP4

1948-71-6 | N-Acetyl-L-tyrosinamide

AG003SP4

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CAS Number	1948-71-6
Catalog Number	AG003SP4(AGN-PC-0QN7QV)
Chemical Name	N-Acetyl-L-tyrosinamide
EC Number	217-756-4
IUPAC Name	(2S)-2-acetamido-3-(4-hydroxyphenyl)propanamide
InChI	InChI=1S/C11H14N2O3/c1-7(14)13-10(11(12)16)6-8-2-4-9(15)5-3-8/h2-5,10,15H,6H2,1H3,(H2,12,16)(H,13,14)/t10-/m0/s1
InChI Key	RJNKBEQRBIJDNM-JTQLQIEISA-N
MDL Number	MFCD00002391
Molecular Formula	C11H14N2O3
Molecular Weight	222.2405
SMILES	O=C(N)[C@@H](NC(C)=O)CC1=CC=C(O)C=C1
UNII	X315200H5U
Synonyms	N-acetyltyrosinamide, N-acetyltyrosylamide, 1948-71-6, AC-TYR-NH2, N-Acetyl-L-tyrosinamide, N-Acetyl-L-tryrosinamide, N-Acetyl-L-tyrosine amide, Ac-Tyr-NH, UNII-X315200H5U, X315200H5U, (S)-2-acetamido-3-(4-hydroxyphenyl)propanamide, A-1890, N-Acetyltyrosylamide, EINECS 217-756-4, Acetyl-L-tyrosinamid, zlchem 645, PubChem13182, (2S)-2-acetamido-3-(4-hydroxyphenyl)propanamide, Nalpha-Acetyltyrosinamide, AC1Q5IQI, N|A-Acetyl-L-tyrosinamide, AC1LEH13, AC1Q1K8Y, Nalpha-Acetyl-L-tyrosinamide, SCHEMBL468899, N-.alpha.-Acetyl-L-tyrosinamide, ZLD0095, RJNKBEQRBIJDNM-JTQLQIEISA-N, Benzenepropanamide, .alpha.-(acetylamino)-4-hydroxy-, (S)-, ZINC154679, 6117AH, MFCD00002391, AKOS024257969, ACM1948716, AK208744, CJ-01358, FT-0654008, K-5746, (S)alpha-(Acetylamino)-4-hydroxybenzenepropanamide, 2-(Acetylamino)-3-(4-hydroxyphenyl)propanamide #, Benzenepropanamide,a-(acetylamino)-4-hydroxy-,(as)-, Benzenepropanamide, alpha-(acetylamino)-4-hydroxy-, (S)-, Acetyl tyrosinamide, C11H14N2O3, AR-1K5768, CID735956, C11-H14-N2-O3, Hydrocinnamamide, .alpha.-acetamido-p-hydroxy-, L-, 36177-92-1,

Complexity	260
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	222.1g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	222.244g/mol
Monoisotopic Mass	222.1g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	92.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number