(S)-1-Boc-3-(methylsulfonyloxy)pyrrolidine - CAS 132945-75-6

Catalog:	BB007660
Product Name:	(S)-1-Boc-3-(methylsulfonyloxy)pyrrolidine
CAS:	132945-75-6
Synonyms:	(3S)-3-methylsulfonyloxy-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl (3S)-3-methylsulfonyloxypyrrolidine-1-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	tert-butyl (3S)-3-methylsulfonyloxypyrrolidine-1-carboxylate
Description:	(S)-1-Boc-3-(methylsulfonyloxy)pyrrolidine (CAS# 132945-75-6) is a useful research chemical.
Molecular Weight:	265.33
Molecular Formula:	C10H19NO5S
Canonical SMILES:	CC(C)(C)OC(=O)N1CCC(C1)OS(=O)(=O)C
InChI:	InChI=1S/C10H19NO5S/c1-10(2,3)15-9(12)11-6-5-8(7-11)16-17(4,13)14/h8H,5-7H2,1-4H3/t8-/m0/s1
InChI Key:	KWQRKOSMSFLBTJ-QMMMGPOBSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.99070

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Related Functional Groups

Pyrrolidines

[18471-41-5]
3-Amino-1-phenylpyrrolidine
[1228070-72-1]
(Racemic trans)-1-tert-butyl 3-methyl 4-(2-Chloro-5-methylpyridin-3-yl)pyrrolidine-1,3-dicarboxylate
[2006277-06-9]
1-(5-Bromopentyl)pyrrolidine Hydrobromide
[60298-18-2]
Ethyl 5-oxopyrrolidine-3-carboxylate
[1203499-44-8]
N-(2-Chloro-6-((3-(hydroxymethyl)pyrrolidin-1-yl)methyl)pyridin-3-yl)pivalamide
[98841-68-0]
N-(2-Hydroxybenzoyl)pyrrolidine

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	379
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	265.09839388
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	265.09839388
Rotatable Bond Count:	4
Topological Polar Surface Area:	81.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7