3-Tert-Butyl 4-methyl 2,2-dimethyloxazolidine-3,4-dicarboxylate - CAS 157604-46-1

Catalog:	BB043132
Product Name:	3-Tert-Butyl 4-methyl 2,2-dimethyloxazolidine-3,4-dicarboxylate
CAS:	157604-46-1
Synonyms:	3-tert-butyl 4-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate; Methyl (S)-N-Boc-2,2-dimethyloxazolidine-4-carboxylate; 3-(1,1-dimethylethyl)-4-methyl-(R,S)-2,2-dimethyl-3,4-oxazolidinedicarboxylate; Methyl 3-(Tert-butoxycarbonyl)-2,2-dimethyl-4-oxazoline carboxylic acid methyl ester; Methyl 3-(Tert-butoxycarbonyl)-2,2-dimethyl-4-oxazolidinedicarboxylate; (S)-N-BOC-2,2-dimethyloxazolin-4-carboxylic acid methyl ester

Technical Data

IUPAC Name:	3-O-tert-butyl 4-O-methyl 2,2-dimethyl-1,3-oxazolidine-3,4-dicarboxylate
Description:	3-Tert-Butyl 4-methyl 2,2-dimethyloxazolidine-3,4-dicarboxylate (CAS# 157604-46-1 ) is a useful research chemical.
Molecular Weight:	259.30
Molecular Formula:	C12H21NO5
Canonical SMILES:	CC1(N(C(CO1)C(=O)OC)C(=O)OC(C)(C)C)C
InChI:	InChI=1S/C12H21NO5/c1-11(2,3)18-10(15)13-8(9(14)16-6)7-17-12(13,4)5/h8H,7H2,1-6H3
InChI Key:	ZNBUXTFASGDVCL-UHFFFAOYSA-N
Purity:	95 %

Complexity:	345
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	259.14197277
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	259.14197277
Rotatable Bond Count:	4
Topological Polar Surface Area:	65.1
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4