N-Tosylethylenediamine - CAS 14316-16-6

Name: N-Tosylethylenediamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB009502
Product Name:	N-Tosylethylenediamine
CAS:	14316-16-6
Synonyms:	N-(2-aminoethyl)-4-methylbenzenesulfonamide

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Computed Properties

IUPAC Name:	N-(2-aminoethyl)-4-methylbenzenesulfonamide
Description:	Used in the synthesis of N-(2-tosylamidoethyl)monoazacrown ethers.
Molecular Weight:	214.28
Molecular Formula:	C9H14N2O2S
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)NCCN
InChI:	InChI=1S/C9H14N2O2S/c1-8-2-4-9(5-3-8)14(12,13)11-7-6-10/h2-5,11H,6-7,10H2,1H3
InChI Key:	JATMCAQQSXISOR-UHFFFAOYSA-N
Boiling Point:	363.1 °C at 760 mmHg
Density:	1.214 g/cm³
Appearance:	White to tan solid
MDL:	MFCD00089604
LogP:	2.40400

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Related Functional Groups

Nitrogen Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[937273-31-9]C12H14ClNO4
2-[(Allyloxy)methyl]-1-(2-chloroethoxy)-4-nitrobenzene
[1129-37-9]C7H6N2O3
4-Nitrobenzaldehyde oxime
[1328640-88-5]C7H9F2N3O3
5-((2,2-Difluoroethoxy)methyl)-1-methyl-3-nitro-1H-pyrazole
[614-16-4]C9H7NO
Benzoylacetonitrile
[1191-69-1]C11H21NO
Decyl isocyanate

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GHS Hazard Statement:	H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112341374-A	Compound, preparation method and application of compound as pH ratio detection type fluorescent probe	20201026
CN-112574181-A	Preparation method and application of suvorexant intermediate	20190930
CN-110563650-A	Ratio type two-photon fluorescent probe of sulfatase, synthetic method and application thereof	20190827
CN-108962627-A	A kind of supercapacitor or capacitor batteries of organic system	20170526
CN-108963389-A	It is a kind of for lithium-air battery can gelling system and its preparation method and application	20170526

PMID	Publication Date	Title	Journal
21574550	20110629	Highly enantioselective hydrogenation of quinolines using phosphine-free chiral cationic ruthenium catalysts: scope, mechanism, and origin of enantioselectivity	Journal of the American Chemical Society
17441044	20060717	Mechanism of asymmetric hydrogenation of acetophenone catalyzed by chiral eta(6)-arene-N-tosylethylenediamine-ruthenium(II) complexes	Chemistry, an Asian journal
16819854	20060712	The hydrogenation/transfer hydrogenation network: asymmetric hydrogenation of ketones with chiral eta6-arene/N-Tosylethylenediamine-ruthenium(II) catalysts	Journal of the American Chemical Society

Complexity:	251
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	214.07759887
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	214.07759887
Rotatable Bond Count:	4
Topological Polar Surface Area:	80.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3