1-Boc-2,2-dimethylpyrrolidine - CAS 869527-80-0

Catalog:	BB038138
Product Name:	1-Boc-2,2-dimethylpyrrolidine
CAS:	869527-80-0
Synonyms:	2,2-dimethyl-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl 2,2-dimethylpyrrolidine-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	tert-butyl 2,2-dimethylpyrrolidine-1-carboxylate
Description:	1-Boc-2,2-dimethylpyrrolidine (CAS# 869527-80-0) is a useful research chemical.
Molecular Weight:	199.29
Molecular Formula:	C11H21NO2
Canonical SMILES:	CC1(CCCN1C(=O)OC(C)(C)C)C
InChI:	InChI=1S/C11H21NO2/c1-10(2,3)14-9(13)12-8-6-7-11(12,4)5/h6-8H2,1-5H3
InChI Key:	BQWREAOXJRHDQX-UHFFFAOYSA-N
LogP:	2.73380

Publication Number	Title	Priority Date
WO-2021030711-A1	Alkynyl quinazoline compounds	20190815
WO-2021030554-A1	Process of making cftr modulators	20190814
WO-2021030556-A1	Modulators of cystic fibrosis transmembrane conductance regulator	20190814
WO-2020263847-A1	Solid forms of tert-butyl (s)-2-((2s,3r) -1-amino-3-hydroxy-1-oxobu tan-2-yl)-1-oxo-2, 5-diazaspiro [3.4] octan e-5-carboxylate and methods of preparing them	20190624
TW-202039481-A	Thienopyridine inhibitors of ripk2	20181221

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Complexity:	228
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	199.157228913
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	199.157228913
Rotatable Bond Count:	2
Topological Polar Surface Area:	29.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.2