AG00C0SE

3415-08-5 | 2,​5-​Oxazolidinedione, 4-​[(4-​hydroxyphenyl)​methyl]​-​, (4S)​-

AG00C0SE

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CAS Number	3415-08-5
Catalog Number	AG00C0SE(AGN-PC-0O93ZG)
Chemical Name	2,​5-​Oxazolidinedione, 4-​[(4-​hydroxyphenyl)​methyl]​-​, (4S)​-
IUPAC Name	(4S)-4-[(4-hydroxyphenyl)methyl]-1,3-oxazolidine-2,5-dione
InChI	InChI=1S/C10H9NO4/c12-7-3-1-6(2-4-7)5-8-9(13)15-10(14)11-8/h1-4,8,12H,5H2,(H,11,14)/t8-/m0/s1
InChI Key	HOEAPYNDVBABMC-QMMMGPOBSA-N
MDL Number	MFCD11046653
Molecular Formula	C10H9NO4
Molecular Weight	207.1828
SMILES	C([C@@H]1NC(=O)OC1=O)c1ccc(cc1)O
Synonyms	(S)-4-(4-Hydroxybenzyl)oxazolidine-2,5-dione, 3415-08-5, H-TYR-NCA, TYR-NCA, (4S)-4-[(4-hydroxyphenyl)methyl]-1,3-oxazolidine-2,5-dione, AK109328, L-Tyrosine N-Carboxy anhidide, N-Carbonyl-L-Tyrosine Anhydride, CTK8C5018, KS-00000QWM, DTXSID50707416, ANW-73768, MFCD11046653, AKOS016007813, ZINC100023053, DS-4195, AX8242145, TC-162513, FT-0698285, Z1659, 2,5-Oxazolidinedione, 4-[(4-hydroxyphenyl)methyl]-, (4S)-, Boc-L-serine benzyl ester, N-Carboxy-L-tyrosine anhydride, C10H9NO4, L-Tyr-NCA, 98% - 5G 5g, ACN-043749, 34487-86-0, 59524-02-6,

Complexity	271
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	207.053g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	207.185g/mol
Monoisotopic Mass	207.053g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number