AG00295N

203866-17-5 | 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-

AG00295N

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CAS Number	203866-17-5
Catalog Number	AG00295N(AGN-PC-0QU1UP)
Chemical Name	1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-
IUPAC Name	1-O-tert-butyl 2-O-methyl (2S)-4,4-difluoropyrrolidine-1,2-dicarboxylate
InChI	InChI=1S/C11H17F2NO4/c1-10(2,3)18-9(16)14-6-11(12,13)5-7(14)8(15)17-4/h7H,5-6H2,1-4H3/t7-/m0/s1
InChI Key	RQDZKOOUQIDZOG-ZETCQYMHSA-N
MDL Number	MFCD03094918
Molecular Formula	C11H17F2NO4
Molecular Weight	265.2538
SMILES	COC(=O)[C@@H]1CC(CN1C(=O)OC(C)(C)C)(F)F
Synonyms	203866-17-5, (S)-1-tert-butyl 2-methyl 4,4-difluoropyrrolidine-1,2-dicarboxylate, N-BOC-4,4-DIFLUORO-L-PROLINE METHYL ESTER, 1-tert-butyl 2-methyl (2S)-4,4-difluoropyrrolidine-1,2-dicarboxylate, MFCD03094918, BOC-4,4-DIFLUORO-L-PROLINE METHYL ESTER, SCHEMBL706243, CTK8B5553, DTXSID90456299, RQDZKOOUQIDZOG-ZETCQYMHSA-N, BCP21719, KS-000007LX, ANW-49129, ZINC12359470, AKOS015920188, CS-W001497, PB27589, AJ-61520, AK-76437, BR-76437, CJ-13910, DS-16679, SC-31716, AB0069257, RT-014318, ST24026505, S-4488, N-Boc-4,4-Difluoro-L-proline methyl ester, 97%, J-013267, N-T-BOC-4,4-DIFLUORO-L-PROLINE METHYL ESTER, 1-(tert-Butoxycarbonyl)-4,4-difluoro-L-proline methyl ester, METHYL (S)-1-BOC-4,4-DIFLUOROPYRROLIDINE-2-CARBOXYLATE, (S)-4,4-Difluoro-N-Boc-pyrrolidine-2-carboxylic acid methyl ester, 1-(tert-butyl) 2-methyl (S)-4,4-difluoropyrrolidine-1,2-dicarboxylate, 1-O-tert-butyl 2-O-methyl (2S)-4,4-difluoropyrrolidine-1,2-dicarboxylate, 1-tert-butyl 2-methyl(2s)-4,4-difluoropyrrolidine-1,2-dicarboxylate, (S)-4,4-difluoro-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl ester, Methyl (2S)-N-(tert-butyloxycarbonyl)-4,4-difluoropyrrolidine-2-carboxylate, 1,2-Pyrrolidinedicarboxylic acid, 4,4-difluoro-, 1-(1,1-dimethylethyl) 2-methyl ester, (2S)-, CID11129200, Tert-butyl Methyl (2S)-4,4-difluoropyrrolidine-1,2-dicarboxylate, 1-TERT-BUTYL 2-METHYL (2R)-4,4-DIFLUOROPYRROLIDINE-1,2-DICARBOXYLATE, 647857-74-7,

Complexity	351
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	265.113g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	265.257g/mol
Monoisotopic Mass	265.113g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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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