AG00BEW3

214852-61-6 | Z-D-Dab(Boc)-Oh DCHA

AG00BEW3

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CAS Number	214852-61-6
Catalog Number	AG00BEW3(AGN-PC-0QY2G8)
Chemical Name	Z-D-Dab(Boc)-Oh DCHA
IUPAC Name	N-cyclohexylcyclohexanamine;(2R)-4-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(phenylmethoxycarbonylamino)butanoic acid
InChI	InChI=1S/C17H24N2O6.C12H23N/c1-17(2,3)25-15(22)18-10-9-13(14(20)21)19-16(23)24-11-12-7-5-4-6-8-12;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-8,13H,9-11H2,1-3H3,(H,18,22)(H,19,23)(H,20,21);11-13H,1-10H2/t13-;/m1./s1
InChI Key	CYMIEBREXUYHGN-BTQNPOSSSA-N
MDL Number	MFCD01318750
Molecular Formula	C29H47N3O6
Molecular Weight	533.7000
SMILES	O=C(O)[C@H](NC(OCC1=CC=CC=C1)=O)CCNC(OC(C)(C)C)=O.C2(NC3CCCCC3)CCCCC2
Synonyms	214852-61-6, Z-D-DAB(BOC)-OH DCHA, Dicyclohexylamine (R)-2-(((benzyloxy)carbonyl)amino)-4-((tert-butoxycarbonyl)amino)butanoate, (2R)-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-({[(phenylmethyl)oxy]carbonyl}amino)butanoic acid dicyclohexylamine salt, Z-D-Dab(Boc)-OH*DCHA, CTK8B7874, DTXSID10678754, CYMIEBREXUYHGN-BTQNPOSSSA-N, BCP14668, EBD41574, 0929AB, ANW-58838, MFCD01318750, AKOS015893084, DS-14443, AX8032646, RT-016304, FT-0772891, K-6147, 852D616, I04-1233, N-a-Z-N-?-Boc-D-2,4-diaminobutyric aciddicyclohexylaminesalt, N-Cbz-N'-BoC-D-2,4-diaminobutyric acid dicyclohexylamine salt, (2R)-2-{[(Benzyloxy)carbonyl]amino}-4-[(tert-butoxycarbonyl)amino]butanoic acid--N-cyclohexylcyclohexanamine (1/1), (2R)-4-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-2-({[(phenylmethyl)oxy]carbonyl}amino)butanoic acid dicyclohexylamine salt;, N-alpha-Benzyloxycarbonyl-N-gamma-(t-butyloxycarbonyl)-D-2,4-diaminobutyric acid dicyclohexylamine, Z-Dab(Boc)-OH.DCHA, Z-D-Dab(Boc)-OH.DCHA, C29H47N3O6, Dicyclohexylamine(R)-2-(((benzyloxy)carbonyl)amino)-4-((tert-butoxycarbonyl)amino)butanoate, 3350-13-8,

Complexity	571
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	533.346g/mol
Formal Charge	0
Heavy Atom Count	38
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	533.71g/mol
Monoisotopic Mass	533.346g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	126A^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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