AG002BML

198561-07-8 | 4-Pentynoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-

AG002BML

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CAS Number	198561-07-8
Catalog Number	AG002BML(AGN-PC-0O6U0S)
Chemical Name	4-Pentynoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-ynoic acid
InChI	InChI=1S/C20H17NO4/c1-2-7-18(19(22)23)21-20(24)25-12-17-15-10-5-3-8-13(15)14-9-4-6-11-16(14)17/h1,3-6,8-11,17-18H,7,12H2,(H,21,24)(H,22,23)/t18-/m0/s1
InChI Key	DJGMNCKHNMRKFM-SFHVURJKSA-N
MDL Number	MFCD01075095
Molecular Formula	C20H17NO4
Molecular Weight	335.3533
SMILES	C(=O)(OCC1C2=CC=CC=C2C2=CC=CC=C12)N[C@@H](CC#C)C(=O)O
Synonyms	Fmoc-L-Propargylglycine, 198561-07-8, Fmoc-Pra-OH, (S)-2-(Fmoc-amino)-4-pentynoic acid, Fmoc-propargyl-Gly-OH, MFCD01075095, (S)-N-Fmoc-2-(2'-propynyl)glycine, (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-ynoic acid, 4-Pentynoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-, J-300362, Fmoc-Propargyl-Gly-OH;(S)-2-(Fmoc-amino)-4-pentynoic acid, (2S)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}pent-4-ynoic acid, (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)pent-4-ynoic acid, 4-Pentynoicacid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2S)-, AK170049, Fmoc-L-Pra-OH, Fmoc-Gly(propargyl)-OH, N-Fmoc-L-propargylglycine, N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-L-propargylglycine, AC1MC16U, Fmoc-alpha-Propargyl-Gly-OH, Fmoc-(S)-2-Propargylglycine, SCHEMBL119866, CTK0H4118, DTXSID80370319, DJGMNCKHNMRKFM-SFHVURJKSA-N, ZINC2572518, ZX-AT014710, CF-385, AKOS015948708, AC-9949, ACN-044473, AM82637, CS-W011926, FCH2715084, FL378-1, GS-6245, OR14676, RTR-009239, (S)-N-Fmoc-2-(2'-pro pynyl)glycine, KS-00000J29, AN-30088, M503, AB0015249, TL8006256, TR-009239, F0926, Fmoc-propargyl-Gly-OH, >=98.0% (HPLC), FT-0657924, M-1163, 561F078, (2S)-2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-4-pentynoic acid, (S)-2-(((9H-fluoren-9-yl)methoxy)carbonylamino)pent-4-ynoic acid, (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pent-4-ynoic acid, (2S)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-pentynoic acid, C20H17NO4, CID2734461, 2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-ynoic Acid,

Complexity	529
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	335.116g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	335.359g/mol
Monoisotopic Mass	335.116g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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