AG0034JO

89483-07-8 | Boc-L-cyclopropylalanine-DCHA

AG0034JO

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CAS Number	89483-07-8
Catalog Number	AG0034JO(AGN-PC-0VP2QL)
Chemical Name	Boc-L-cyclopropylalanine-DCHA
IUPAC Name	N-cyclohexylcyclohexanamine;(2S)-3-cyclopropyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI	InChI=1S/C12H23N.C11H19NO4/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-11(2,3)16-10(15)12-8(9(13)14)6-7-4-5-7/h11-13H,1-10H2;7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14)/t;8-/m.0/s1
InChI Key	MQINYDUVLDJIAC-WDBKTSHHSA-N
MDL Number	MFCD03093869
Molecular Formula	C23H42N2O4
Molecular Weight	410.5906
SMILES	O=C([C@@H](NC(OC(C)(C)C)=O)CC1CC1)O.C2(NC3CCCCC3)CCCCC2
Synonyms	89483-07-8, Boc-L-Cyclopropylalanine-DCHA, Dicyclohexylamine (S)-2-((tert-butoxycarbonyl)amino)-3-cyclopropylpropanoate, Boc-L-Cyclopropylalanine dicyclohexylamine salt, Boc-L-Cyclopropylalanine DCHA, Boc-Ala(beta-cyclopropyl)-OH dicyclohexylammonium salt, Boc--cyclopropyl-Ala-OH DCHA, C23H42N2O4, boc-ala(cpro)-oh dcha, boc-ala(cyclopropyl)-oh dcha, SCHEMBL9099315, boc-beta-cyclopropyl-ala-oh dcha, boc-beta-cyclopropyl-alanine dcha, CTK8B2948, KS-00000HDH, MQINYDUVLDJIAC-WDBKTSHHSA-N, boc-beta-cyclopropyl-l-ala-oh dcha, boc-beta-cyclopropyl-l-alanine dcha, N-cyclohexylcyclohexanamine;(2S)-3-cyclopropyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid, ANW-41432, MFCD03093869, AKOS015949945, AC-24131, AC-25303, AN-35230, AS-15807, Boc-beta-cyclopropyl-L-Ala-OH (DCHA), Q846, AB0017838, AX8158088, FT-0649767, M-1051, Boc-L-Cyclopropylalanine Dicyclohexylammonium Salt, N-BOC-L-3-CYCLOPROPYLALANINE DICYCLOHEXYAMMONIUM SALT, (2S)-2-[(tert-butoxycarbonyl)amino]-3-cyclopropylpropanoic acid; dicha, 3-cyclopropyl-N-(tert-butoxycarbonyl)-L-alanine N,N-dicyclohexylamine, (2S)-2-(tert-butoxycarbonylamino)-3-cyclopropyl-propanoic acid; N-cyclohexylcyclohexanamine, (2S)-2-(tert-butoxycarbonylamino)-3-cyclopropyl-propanoic acid;N-cyclohexylcyclohexanamine, (2S)-2-(tert-butoxycarbonylamino)-3-cyclopropyl-propionic acid;dicyclohexylamine, N-cyclohexylcyclohexanamine;(2S)-3-cyclopropyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid, BOC-L-Cyclopropylalanine, ACN-034117, 89483-06-7, (S)-2-(BOC-AMINO)-3-CYCLOPROPYLPROPANOIC ACID,

Complexity	394
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	410.314g/mol
Formal Charge	0
Heavy Atom Count	29
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	410.599g/mol
Monoisotopic Mass	410.314g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	87.7A^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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