(R)-2-N-Boc-aminomethylpyrrolidine - CAS 719999-54-9

Catalog:	BB034516
Product Name:	(R)-2-N-Boc-aminomethylpyrrolidine
CAS:	719999-54-9
Synonyms:	N-[[(2R)-2-pyrrolidinyl]methyl]carbamic acid tert-butyl ester; tert-butyl N-[[(2R)-pyrrolidin-2-yl]methyl]carbamate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	tert-butyl N-[[(2R)-pyrrolidin-2-yl]methyl]carbamate
Description:	(R)-2-N-Boc-aminomethylpyrrolidine (CAS# 719999-54-9) is a useful research chemical.
Molecular Weight:	200.28
Molecular Formula:	C10H20N2O2
Canonical SMILES:	CC(C)(C)OC(=O)NCC1CCCN1
InChI:	InChI=1S/C10H20N2O2/c1-10(2,3)14-9(13)12-7-8-5-4-6-11-8/h8,11H,4-7H2,1-3H3,(H,12,13)/t8-/m1/s1
InChI Key:	DPJPFGHHTJLWQQ-MRVPVSSYSA-N
Boiling Point:	303.9 °C at 760 mmHg
Density:	0.997 g/cm³
LogP:	1.98280

Publication Number	Title	Priority Date
WO-2019204505-A2	K-ras modulators with a vinyl sulfonamide moiety	20180418
US-2019315717-A1	Benzimidazole and indole compounds and uses thereof	20180413
TW-201934548-A	Formamide compound and its use	20180220
US-2019256520-A1	Indazole compounds and uses thereof	20180220
US-2019382380-A1	Carboxamide compounds and uses thereof	20180220

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Related Functional Groups

Pyrrolidines

[55727-59-8]
2-(Pyrrolidin-1-ylmethyl)aniline
[5724-76-5]
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[1228070-72-1]
(Racemic trans)-1-tert-butyl 3-methyl 4-(2-Chloro-5-methylpyridin-3-yl)pyrrolidine-1,3-dicarboxylate
[5747-92-2]
Ethyl 1-benzyl-pyrrolidine-3-carboxylate
[14398-95-9]
Ethyl 1-methylpyrrolidine-3-carboxylate
[36821-26-8]
Ethyl 2-oxopyrrolidine-3-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H319 (50%): 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, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	199
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	200.152477885
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	200.152477885
Rotatable Bond Count:	4
Topological Polar Surface Area:	50.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1