AG00IB4V

63039-48-5 | 4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-

AG00IB4V

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CAS Number	63039-48-5
Catalog Number	AG00IB4V(AGN-PC-0ODZSZ)
Chemical Name	4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-
IUPAC Name	(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic acid
InChI	InChI=1S/C10H15NO4/c1-5-6-7(8(12)13)11-9(14)15-10(2,3)4/h1,7H,6H2,2-4H3,(H,11,14)(H,12,13)/t7-/m0/s1
InChI Key	AMKHAJIFPHJYMH-ZETCQYMHSA-N
MDL Number	MFCD01320855
Molecular Formula	C10H15NO4
Molecular Weight	213.2304
SMILES	C#CC[C@H](NC(OC(C)(C)C)=O)C(O)=O
Synonyms	63039-48-5, Boc-L-Propargylglycine, (S)-2-((tert-Butoxycarbonyl)amino)pent-4-ynoic acid, Boc-Pra-OH, Boc-propargyl-Gly-OH, N-Boc-2-Propargyl-L-glycine, MFCD01320855, (2S)-2-(tert-butoxycarbonylamino)pent-4-ynoic acid, 4-Pentynoic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, (2S)-, EN300-89566, (S)-2-(tert-butoxycarbonylamino)pent-4-ynoic acid, (2S)-2-{[(tert-butoxy)carbonyl]amino}pent-4-ynoic acid, Boc-Propargyl-Gly-OH;(S)-2-(Boc-amino)-4-pentynoic acid, (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic acid, (S)-N-BOC-Propargylglycine, 95%, (S)-2-(Boc-amino)-4-pentynoic Acid, boc-propargylglycine, AK-23882, AK-35925, (S)-2-Boc-amino-4-pentynoic acid, boc-l-propargyl glycine, Boc-Gly(propargyl)-OH, Boc-L-propargyl-glycine, AC1Q1MRK, N-Boc-L-propargylglycine, Boc-L-2-propargylglycine, SCHEMBL755894, AC1MC190, CTK8B5095, KS-00000JKJ, KS-00000JKK, DTXSID00370331, AMKHAJIFPHJYMH-ZETCQYMHSA-N, ACT03116, ZINC2379438, ZX-AT021786, ANW-47552, CB-764, AKOS015919573, BL376-1, CS-W014975, FCH1618898, OR14674, BOC-L-PROPARGYLGLYCINE DCHA SALT, AJ-34579, AN-39052, BBV-44994648, BR-23882, DS-10616, SC-10421, N-(tert-Butoxycarbonyl)-L-propargylglycine, (S)-N-(Tert-butoxycarbonyl)propargylglycine, AB0007097, AX8021897, TR-037344, B4007, Boc-propargyl-Gly-OH, >=98.0% (HPLC), FT-0649769, N-(tert-Butoxycarbonyl)-3-ethynyl-L-alanine, ST24020800, C-5891, (S)-2-tert-butoxycarbonylamino-pent-4-ynoic acid, 039B485, (S)-2-(tert-Butoxycarbonylamino)-4-pentynoic Acid, (S)-N-tert-Butoxycarbonyl-2-amino-4-pentynoic acid, (2S)-2-[(tert-butoxycarbonyl)amino]pent-4-ynoic acid, (2S)-2-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-4-pentynoic acid, (2S)-2-({[(2-Methyl-2-propanyl)oxy]carbonyl}amino)-4-pentynoic acid, (2S)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-pentynoic acid, (S)-N-Boc-Propargylglycine, C10H15NO4, ACN-033929, CID2734488, Boc-propargyl-Gly-OH, 95% - 1G 1g, (R)-2-((tert-Butoxycarbonyl)amino)pent-4-ynoic acid, M113, 63039-46-3, 2-[(2-methylpropan-2-yl)oxycarbonylamino]pent-4-ynoic Acid, 63039-49-6,

Complexity	294
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	213.1g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	213.233g/mol
Monoisotopic Mass	213.1g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317
Packing Group
Precautionary statements	P261-P280
UN Code

Certificate of Analysis

Lot Number