2-(N-Boc-N-ethylamino)ethylamine - CAS 105628-63-5

Name: 2-(N-Boc-N-ethylamino)ethylamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB001680
Product Name:	2-(N-Boc-N-ethylamino)ethylamine
CAS:	105628-63-5
Synonyms:	N-(2-aminoethyl)-N-ethylcarbamic acid tert-butyl ester; tert-butyl N-(2-aminoethyl)-N-ethylcarbamate

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	tert-butyl N-(2-aminoethyl)-N-ethylcarbamate
Description:	Protected ethylenediamine, used for ethylenediamine addition.
Molecular Weight:	188.27
Molecular Formula:	C9H20N2O2
Canonical SMILES:	CCN(CCN)C(=O)OC(C)(C)C
InChI:	InChI=1S/C9H20N2O2/c1-5-11(7-6-10)8(12)13-9(2,3)4/h5-7,10H2,1-4H3
InChI Key:	GCORMRJHUSHORI-UHFFFAOYSA-N
Boiling Point:	253.3 °C at 760 mmHg
Density:	0.982 g/cm³
LogP:	1.90240

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Related Functional Groups

Amines and Anilines

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P301+P312, P330, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021099793-A1	1-aminosulfonyl-2-carboxypyrrole derivatives as metallo-beta-lactamase inhibitors	20191120
WO-2020227325-A1	Heterobifunctional compounds as degraders of hpk1	20190506
WO-2020168927-A1	Nitrogen-containing fused cyclic compound, preparation method therefor and use thereof	20190219
CN-113195469-A	Nitrogen-containing heterocyclic compound, preparation method and application thereof	20190219
US-2020121681-A1	Methods for hair follicle stem cell proliferation	20181017

Complexity:	164
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.152477885
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	188.152477885
Rotatable Bond Count:	5
Topological Polar Surface Area:	55.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5