AG00C7YB

331730-08-6 | Boc-l-2-furylalanine-dcha

AG00C7YB

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CAS Number	331730-08-6
Catalog Number	AG00C7YB(AGN-PC-0WAICS)
Chemical Name	Boc-l-2-furylalanine-dcha
IUPAC Name	N-cyclohexylcyclohexanamine;(2S)-3-(furan-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI	InChI=1S/C12H17NO5.C12H23N/c1-12(2,3)18-11(16)13-9(10(14)15)7-8-5-4-6-17-8;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-6,9H,7H2,1-3H3,(H,13,16)(H,14,15);11-13H,1-10H2/t9-;/m0./s1
InChI Key	QYEOQPFAYJEDFE-FVGYRXGTSA-N
MDL Number	MFCD01860894
Molecular Formula	C24H40N2O5
Molecular Weight	436.5848
SMILES	O=C(O)[C@@H](NC(OC(C)(C)C)=O)CC1=CC=CO1.C2(NC3CCCCC3)CCCCC2
Synonyms	331730-08-6, BOC-L-2-FURYLALANINE-DCHA, Dicyclohexylamine (S)-2-((tert-butoxycarbonyl)amino)-3-(furan-2-yl)propanoate, Boc-beta-(2-furyl)-Ala-OH.DCHA, MFCD01860894, BOC-L-2-FURYLALANINE DCHA SALT, AK163664, Dicycloammonium fur-2-yl-L-alanine, N-BOC protected, Boc-L-2-Furylalanine.DCHA, Boc-Ala(2-furyl)-OH DCHA, KS-00000KIX, Boc-beta-(2-furyl)-Ala-OHCHA, ZX-AT014689, CB-755, AKOS015948716, BL368-1, DS-8297, OR14650, AN-31350, AX8033244, Boc-L-2-Furylalanine dicyclohexylamine salt, TL8006170, ST24046505, Boc-3-(2-Furyl)-L-alanine dicyclohexylamine, K-4651, 206B402, J-019055, Boc-beta-(2-furyl)-Ala-OH (dicyclohexylammonium) salt, (2S)-2-[(tert-butoxycarbonyl)amino]-3-(furan-2-yl)propanoic acid; dicha, dicyclohexylamine (S)-2-(tert-butoxycarbonylamino)-3-(furan-2-yl)propanoate, (2S)-2-(tert-butoxycarbonylamino)-3-(2-furyl)propanoic acid; N-cyclohexylcyclohexanamine, (2S)-2-(tert-butoxycarbonylamino)-3-(2-furyl)propanoic acid;N-cyclohexylcyclohexanamine, (2S)-2-(tert-butoxycarbonylamino)-3-(2-furyl)propionic acid;dicyclohexylamine, Boc-beta-(2-furyl)-Ala-OH (dicyclohexylammonium) salt, purum, >=98.0% (HPLC), N-cyclohexylcyclohexanamine;(2S)-3-(2-furanyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid, N-cyclohexylcyclohexanamine;(2S)-3-(furan-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, Boc-L-3-(2-Furyl)-alanine, Boc-beta-(2-furyl)-Ala-OH?DCHA, 145206-40-2, Boc-3-(2-Furyl)-L-alaninedicyclohexylaminesalt,

Complexity	426
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	436.294g/mol
Formal Charge	0
Heavy Atom Count	31
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	436.593g/mol
Monoisotopic Mass	436.294g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	101A^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-H413
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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