AG003OGB

65710-58-9 | Boc-dap(z)-oh dcha

AG003OGB

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CAS Number	65710-58-9
Catalog Number	AG003OGB(AGN-PC-0THUSQ)
Chemical Name	Boc-dap(z)-oh dcha
IUPAC Name	N-cyclohexylcyclohexanamine;(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxycarbonylamino)propanoic acid
InChI	InChI=1S/C16H22N2O6.C12H23N/c1-16(2,3)24-15(22)18-12(13(19)20)9-17-14(21)23-10-11-7-5-4-6-8-11;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-8,12H,9-10H2,1-3H3,(H,17,21)(H,18,22)(H,19,20);11-13H,1-10H2/t12-;/m0./s1
InChI Key	RPWGTQRQPVPFKR-YDALLXLXSA-N
MDL Number	MFCD00236880
Molecular Formula	C28H45N3O6
Molecular Weight	519.6734
SMILES	C1CCC(CC1)NC1CCCCC1.[H][C@@](CNC(=O)OCC1=CC=CC=C1)(NC(=O)OC(C)(C)C)C(O)=O
Synonyms	65710-58-9, BOC-DAP(Z)-OH DCHA, Boc-Dap(Z)-OH.DCHA, Dicyclohexylamine (S)-3-(((benzyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoate, Boc-Dap(Z)-OH.DCHA salt, Boc-Dap(Z)-OH (dicyclohexylammonium) salt, MFCD00236880, RPWGTQRQPVPFKR-YDALLXLXSA-N, AC1MBSGD, PubChem23819, Boc-Dap(Z)-OH?CHA, SCHEMBL646589, CTK8C0036, DTXSID10373156, ANW-63922, KM0946, C16H22N2O6.C12H23N, AKOS015901170, CS-W011484, Boc-Dap(Z)-OH dicyclohexylammonium salt, AK-61273, AX8034532, TC-152667, FT-0698768, ST24046506, Z5939, 710B589, I14-15353, Boc-3-(Z-amino)-L-alanine (dicyclohexylammonium) salt, Boc-Dap(Z)-OH (dicyclohexylammonium) salt, >=98.0% (HPLC), N|A-Boc-N|A-Z-L-2,3-diaminopropionic acid (dicyclohexylammonium) salt, (2S)3-benzyloxycarbonylamino-2-tert-butoxycarbonylaminopropionic acid dicyclohexylamine salt, 3-{[(benzyloxy)carbonyl]amino}-N-(tert-butoxycarbonyl)-L-alanine N-cyclohexylcyclohexanamine, 3-{[(Benzyloxy)carbonyl]amino}-N-(tert-butoxycarbonyl)-L-alanine--N-cyclohexylcyclohexanamine (1/1), N-alpha-t-Butyloxycarbonyl-N-beta-benzyloxycarbonyl-L-2,3-diaminopropionic acid dicyclohexylamine, N-cyclohexylcyclohexanamine; (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(phenylmethoxycarbonylamino)propanoic acid, BOC-DAP -OHDCHA, ACN-026307, CID2755949, CID 2755949, N-a-Boc-N-ss-Z-L-2,3-diaminopropionicaciddicyclohexylaminesalt, (S)-2-(Boc-amino)-3-(Cbz-amino)propionic acid dicyclohexylamine salt, Dicyclohexylamine(S)-3-(((benzyloxy)carbonyl)amino)-2-((tert-butoxycarbonyl)amino)propanoate, L-Alanine, N-[(1,1-dimethylethoxy)carbonyl]-3-[[(phenylmethoxy)carbonyl]amino]-, compd. with N-cyclohexylcyclohexanamine (1:1),

Complexity	556
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	519.331g/mol
Formal Charge	0
Heavy Atom Count	37
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	519.683g/mol
Monoisotopic Mass	519.331g/mol
Rotatable Bond Count	11
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
Signal Words	warning
UN Code

Certificate of Analysis

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