Name: Name:1-tert-butyl 3-methyl 2-methylpyrrolidine-1,3-dicarboxylate, Mixture of diastereomers
Brand: Angene
SKU: AG01B88J
Rating: 90 (10 reviews)

1-tert-butyl 3-methyl 2-methylpyrrolidine-1,3-dicarboxylate, Mixture of diastereomers

CAS No.:

1803599-14-5

Catalog Number:

AG01B88J

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

Catalog Number:

AG01B88J

Chemical Name:

1-tert-butyl 3-methyl 2-methylpyrrolidine-1,3-dicarboxylate, Mixture of diastereomers

CAS Number:

1803599-14-5

Molecular Formula:

C12H21NO4

Molecular Weight:

243.2994

MDL Number:

MFCD28348060

IUPAC Name:

1-O-tert-butyl 3-O-methyl 2-methylpyrrolidine-1,3-dicarboxylate

InChI:

InChI=1S/C12H21NO4/c1-8-9(10(14)16-5)6-7-13(8)11(15)17-12(2,3)4/h8-9H,6-7H2,1-5H3

InChI Key:

FXGNPVCOVMTUBO-UHFFFAOYSA-N

SMILES:

COC(=O)C1CCN(C1C)C(=O)OC(C)(C)C

Complexity:

308

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.147g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

243.303g/mol

Monoisotopic Mass:

243.147g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5