Name: Name:1-tert-butyl 2-chloromethyl (2S,4R)-4-(difluoromethoxy)pyrrolidine-1,2-dicarboxylate
Brand: Angene
SKU: AG01BIIC
Rating: 90 (10 reviews)

1-tert-butyl 2-chloromethyl (2S,4R)-4-(difluoromethoxy)pyrrolidine-1,2-dicarboxylate

CAS No.:

2137062-11-2

Catalog Number:

AG01BIIC

Molecular Formula:

C12H18ClF2NO5

Molecular Weight:

329.7248

Catalog Number:

AG01BIIC

Chemical Name:

1-tert-butyl 2-chloromethyl (2S,4R)-4-(difluoromethoxy)pyrrolidine-1,2-dicarboxylate

CAS Number:

2137062-11-2

Molecular Formula:

C12H18ClF2NO5

Molecular Weight:

329.7248

MDL Number:

MFCD30734659

IUPAC Name:

1-O-tert-butyl 2-O-(chloromethyl) 4-(difluoromethoxy)pyrrolidine-1,2-dicarboxylate

InChI:

InChI=1S/C12H18ClF2NO5/c1-12(2,3)21-11(18)16-5-7(20-10(14)15)4-8(16)9(17)19-6-13/h7-8,10H,4-6H2,1-3H3

InChI Key:

OYDZRTSTEBCCKA-UHFFFAOYSA-N

SMILES:

ClCOC(=O)[C@@H]1C[C@H](CN1C(=O)OC(C)(C)C)OC(F)F

Complexity:

388

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

329.084g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

329.725g/mol

Monoisotopic Mass:

329.084g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8