AG003667

117625-90-8 | tert-Butyl 2-formylpyrrolidine-1-carboxylate

AG003667

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CAS Number	117625-90-8
Catalog Number	AG003667(AGN-PC-0KK6OP)
Chemical Name	tert-Butyl 2-formylpyrrolidine-1-carboxylate
IUPAC Name	tert-butyl 2-formylpyrrolidine-1-carboxylate
InChI	InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H3
InChI Key	YDBPZCVWPFMBDH-UHFFFAOYSA-N
MDL Number	MFCD03790896
Molecular Formula	C10H17NO3
Molecular Weight	199.2469
SMILES	C(=O)C1N(CCC1)C(=O)OC(C)(C)C
Synonyms	1-Boc-2-Formylpyrrolidine, 117625-90-8, tert-butyl 2-formylpyrrolidine-1-carboxylate, 2-Formyl-pyrrolidine-1-carboxylic acid tert-butyl ester, N-tert-Butoxycarbonylpyrrole-2-carboxaldehyde, 2-Formylpyrrolidine-1-carboxylic acid tert-butyl ester, 1-Pyrrolidinecarboxylic acid, 2-formyl-, 1,1-dimethylethyl ester, PubChem16909, ACMC-209oqp, ACMC-209o9r, AC1N61GE, SCHEMBL190173, KS-00000HUX, 1-Boc-pyrrolidine-2-carbaldehyde, DTXSID40401032, N-BOC-2-FORMYLPYRROLIDINE, YDBPZCVWPFMBDH-UHFFFAOYSA-N, 1-N-Boc-2-pyrrolidinecarbaldehyde, N-(Tert-Butoxycarbonyl)-d-prolnal, ANW-52236, HT1026, MFCD03790896, SBB092475, AKOS006230071, AB16165, AC-7660, AM90809, AN-8750, CB-3537, CS-W018592, RP25698, TRA0031154, VA50147, tert-butyl 2-formylpyrrolidinecarboxylate, AK-22157, AK-39539, AK-45127, AN-37352, BR-22157, DS-10417, EN002556, SC-28506, SY015934, SY022070, AB0034964, AB1009712, DB-001782, TR-003105, 4CH-007529, 4CH-008710, 4CH-014276, A3466, BB 0263022, FT-0689584, ST24027016, X9212, MFCD00274186 (97%), MFCD03790896 (95%), S-2952, 1-(tert-Butoxycarbonyl)pyrrolidine-2-carbaldehyde, 2-Formyl-pyrrolidine-1-carboxylic acid tert-butyl, 625F908, J-504340, J-523183, 2-formyl -pyrrolidine-1-carboxylic acid tert-butyl ester, 2-formyl-pyrrolidine-l-carboxylic acid tert-butyl ester, 117625-90-8 tert-butyl 2-formylpyrrolidine-1-carboxylate, 2-formyl-1-pyrrolidinecarboxylic acid,1,1-dimethylethyl ester, InChI=1/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H, N-Boc-D-Prolinal, N-BOC-L-Prolinal, (S)-1-Boc-2-Formylpyrrolidine, C10H17NO3, 1-Boc-2-Piperidinecarboxaldehyde, 69610-41-9, N-(tert-Butoxycarbonyl)-D-prolinal, N-(tert-Butoxycarbonyl)-L-prolinal, ZINC02379667, 73365-02-3, CID4227815, (R)-tert-butyl 2-formylpyrrolidine-1-carboxylate, A2433, (1S,4S)-2,5-Diazabicyclo[2.2.1]heptane, (S)-tert-butyl 2-formylpyrrolidine-1-carboxylate, TERT-BUTYL 2-FORMYL-1H-PYRROLE-1-CARBOXYLATE, 1-Pyrrolidinecarboxylicacid,2-formyl-,1,1-dimethylethylester, 2-FORMYL-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER, 157634-02-1,

Complexity	232
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.121g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.25g/mol
Monoisotopic Mass	199.121g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	46.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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