AG003OG8

327156-92-3 | Dicyclohexylamine (S)-4-(((allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)butanoate

AG003OG8

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CAS Number	327156-92-3
Catalog Number	AG003OG8(AGN-PC-0R83HK)
Chemical Name	Dicyclohexylamine (S)-4-(((allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)butanoate
IUPAC Name	N-cyclohexylcyclohexanamine;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(prop-2-enoxycarbonylamino)butanoic acid
InChI	InChI=1S/C13H22N2O6.C12H23N/c1-5-8-20-11(18)14-7-6-9(10(16)17)15-12(19)21-13(2,3)4;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h5,9H,1,6-8H2,2-4H3,(H,14,18)(H,15,19)(H,16,17);11-13H,1-10H2/t9-;/m0./s1
InChI Key	YICPGWNKDOPUOG-FVGYRXGTSA-N
MDL Number	MFCD01862280
Molecular Formula	C25H45N3O6
Molecular Weight	483.6413
SMILES	O=C(O)[C@@H](NC(OC(C)(C)C)=O)CCNC(OCC=C)=O.C1(NC2CCCCC2)CCCCC1
Synonyms	327156-92-3, Dicyclohexylamine (S)-4-(((allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)butanoate, Boc-Dab(Alloc)-OH (dicyclohexylammonium) salt, AK-61257, BOC-DAB(ALLOC)-OH DCHA, CTK8C0041, KS-00000KIS, DTXSID60584972, ANW-63927, MFCD01862280, AKOS016003816, CS-W011521, DS-14733, AX8033221, Boc-Dab(Alloc)-OH dicyclohexylammonium salt, RT-021675, FT-0771796, ST24046507, 156B923, J-018854, Boc-Dab(Alloc)-OH (dicyclohexylammonium) salt, >=99.0% (HPLC), N|A-Alloc-N|A-Boc-L-2,4-diaminobutyric acid (dicyclohexylammonium) salt, N|A-Boc-N|A-Alloc-L-2,4-diaminobutyric acid (dicyclohexylammonium) salt, (2S)-2-[(tert-Butoxycarbonyl)amino]-4-({[(prop-2-en-1-yl)oxy]carbonyl}amino)butanoic acid--N-cyclohexylcyclohexanamine (1/1), N-alpha-t-Butyloxycarbonyl-N-beta-allyloxycarbonyl-L-2,4-diaminobutyric acid dicyclohexylamine, Boc-Dab(Alloc)-OH.DCHA, Dicyclohexylamine(S)-4-(((allyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)butanoate,

Complexity	505
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	483.331g/mol
Formal Charge	0
Heavy Atom Count	34
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	483.65g/mol
Monoisotopic Mass	483.331g/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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