AG00295P

203866-15-3 | 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester, (2S)-

AG00295P

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CAS Number	203866-15-3
Catalog Number	AG00295P(AGN-PC-0QU1TL)
Chemical Name	1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester, (2S)-
IUPAC Name	(2S)-4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI	InChI=1S/C10H15F2NO4/c1-9(2,3)17-8(16)13-5-10(11,12)4-6(13)7(14)15/h6H,4-5H2,1-3H3,(H,14,15)/t6-/m0/s1
InChI Key	WTMZYKCXBXPVPT-LURJTMIESA-N
MDL Number	MFCD03094917
Molecular Formula	C10H15F2NO4
Molecular Weight	251.2272
SMILES	O=C(N1CC(C[C@H]1C(=O)O)(F)F)OC(C)(C)C
Synonyms	203866-15-3, N-BOC-4,4-DIFLUORO-L-PROLINE, (S)-1-(tert-Butoxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid, N-t-BOC-4,4-Difluoro-L-proline, (2S)-1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-2-carboxylic acid, 1-(TERT-BUTOXYCARBONYL)-4,4-DIFLUORO-L-PROLINE, MFCD03094917, (S)-1-(Boc)-4,4-difluoropyrrolidine-2-carboxylic acid, (2S)-4,4-difluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid, C10H15F2NO4, n-boc-4,4-difluoroproline, SCHEMBL185992, CTK4E4088, DTXSID90629289, WTMZYKCXBXPVPT-LURJTMIESA-N, ANW-74245, FD2039, ZINC12359348, (2s)-1-(tert-butoxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid, AKOS005064113, AKOS015950477, CS-W004000, N-Boc-4,4-difluoro-L-proline, 97%, PB21203, RP07263, RTC-069351, AJ-61468, AM807695, AN-17200, BC653055, DS-16678, AB0040547, DB-001407, TC-069351, B4202, N-(tert-butoxycarbonyl) 4,4-difluoroproline, ST24035742, Y8168, Q-1632, N-(tert-Butoxycarbonyl)-4,4-difluoro-L-proline, 3S110621, (S)-1-Boc-4,4-difluoro-2-pyrrolidinecarboxylic Acid, I14-55592, (S)-1-BOC-4,4-DIFLUOROPYRROLIDINE-2-CARBOXYLIC ACID, (2S)-1-tert-butoxycarbonyl-4,4-difluoro-pyrrolidine-2-carboxylic acid, (2S)-4,4-Difluoro-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, (2S)-N-(tert-Butyloxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylic acid, (S)-1-(tert-butoxycarbonyl)-4,4-di fluoro pyrrolidine-2-carboxylic acid, (S)-1-(tert-Butoxycarbonyl)-4,4-difluoro-2-pyrrolidinecarboxylic Acid, (S)-4,4-Difluoro-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester, 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl)ester, (2R)-, 1,2-Pyrrolidinedicarboxylicacid, 4,4-difluoro-, 1-(1,1-dimethylethyl) ester, (2S)-, 1369594-34-2, 1-2 weeks, BOC-4,4-DIFLUORO-L-PROLINE, A4436, N-Boc-4,4-difluoro-L-proline, 97% 250mg, Boc-4,4-difluoro-L-proline, 98% - 1G 1g, (2R)-1-[(tert-butoxy)carbonyl]-4,4-difluoropyrrolidine-2-carboxylic acid, 536747-87-2, 55463-74-6, N/A,

Complexity	338
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	251.097g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	251.23g/mol
Monoisotopic Mass	251.097g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	66.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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