AG001YAS

16879-90-6 | L-Tyrosine, O-(1,1-dimethylethyl)-N-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)

AG001YAS

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CAS Number	16879-90-6
Catalog Number	AG001YAS(AGN-PC-0Q9AOS)
Chemical Name	L-Tyrosine, O-(1,1-dimethylethyl)-N-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1)
EC Number	240-910-7
IUPAC Name	N-cyclohexylcyclohexanamine;(2S)-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid
InChI	InChI=1S/C21H25NO5.C12H23N/c1-21(2,3)27-17-11-9-15(10-12-17)13-18(19(23)24)22-20(25)26-14-16-7-5-4-6-8-16;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-12,18H,13-14H2,1-3H3,(H,22,25)(H,23,24);11-13H,1-10H2/t18-;/m0./s1
InChI Key	FDNJRKLIHBJXIR-FERBBOLQSA-N
MDL Number	MFCD00038245
Molecular Formula	C33H48N2O5
Molecular Weight	552.7446
SMILES	C1CCC(CC1)NC1CCCCC1.[H][C@@](CC1=CC=C(OC(C)(C)C)C=C1)(NC(=O)OCC1=CC=CC=C1)C(O)=O
Synonyms	16879-90-6, Z-Tyr(tBu)-OH.DCHA, Z-Tyr(tbu)-oh dcha, Dicyclohexylamine (S)-2-(((benzyloxy)carbonyl)amino)-3-(4-(tert-butoxy)phenyl)propanoate, Cbz-Tyr(tBu)-OH.DCHA, W-107897, Z-Tyr(tBu)-OH dicyclohexylammonium salt, AK-61072, EINECS 240-910-7, Z-Tyr(tBu)-OHCHA, Z-Tyr(tBu)-OH?CHA, CTK8B7882, ANW-58853, CZ-049, MFCD00038245, RTR-007348, N-((Benzyloxy)carbonyl)-O-(tert-butyl)-L-tyrosine, compound with dicyclohexylamine (1:1), AS-12122, SC-09950, AB0011341, AX8002022, TL8006215, Z-Tyr(tBu)-OH (dicyclohexylammonium) salt, FT-0637451, ST24030319, B-7425, 879Z906, C-23203, N-Cbz-O-t-butyl-L-tyrosine (dicyclohexylammonium) salt, N-Z-O-tert-butyl-L-tyrosine (dicyclohexylammonium) salt, N-alpha-Benzyloxycarbonyl-O-t-butyl-L-tyrosine dicyclohexylamine, Dicyclohexylamine (S)-2-(((benzyloxy)carbonyl)-amino)-3-(4-(tert-butoxy)phenyl)propanoate, dicyclohexylamine (S)-2-(benzyloxycarbonylamino)-3-(4-tert-butoxyphenyl)propanoate, O-(1,1-Dimethylethyl)-N-[(phenylmethoxy)carbonyl]-L-theronine-N- cyclohexylcyclohexanamine, L-Tyrosine, O-(1,1-dimethylethyl)-N-[(phenylmethoxy)carbonyl]-, compd. with N-cyclohexylcyclohexanamine (1:1), Z-Thr(Bzl)-OH, 6-Chloro-2-pyridinol, 6-Chloro-2-hydroxypyridine, FDNJRKLIHBJXIR-FERBBOLQSA-N, C33H48N2O5, C21H25NO5.C12H23N, Z-Tyr(tBu)-OH.DCHA - 5G 5g, A6932, C21-H25-N-O5.C12-H23-N, n-benzyloxycarbonyl-o-tert-butyl-l-tyrosine dicyclohexylamine salt, N-[(benzyloxy)carbonyl]-O-(tert-butyl)-L-tyrosine, compound with dicyclohexylamine (1:1),

Complexity	590
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	552.356g/mol
Formal Charge	0
Heavy Atom Count	40
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	552.756g/mol
Monoisotopic Mass	552.356g/mol
Rotatable Bond Count	11
Topological Polar Surface Area	96.9A^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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