(1S,2S)-(-)-1,2-Diphenylethylenediamine - CAS 29841-69-8

Name: (1S,2S)-(-)-1,2-Diphenylethylenediamine
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB020342
Product Name:	(1S,2S)-(-)-1,2-Diphenylethylenediamine
CAS:	29841-69-8
Synonyms:	(1S,2S)-1,2-diphenylethane-1,2-diamine; (1S,2S)-1,2-diphenylethane-1,2-diamine

Technical Data

IUPAC Name:	(1S,2S)-1,2-diphenylethane-1,2-diamine
Description:	(1S,2S)-(-)-1,2-Diphenylethylenediamine (CAS# 29841-69-8 ) is a useful research chemical.
Molecular Weight:	212.29
Molecular Formula:	C14H16N2
Canonical SMILES:	C1=CC=C(C=C1)C(C(C2=CC=CC=C2)N)N
InChI:	InChI=1S/C14H16N2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-14H,15-16H2/t13-,14-/m0/s1
InChI Key:	PONXTPCRRASWKW-KBPBESRZSA-N
Boiling Point:	353.9 °C / 760 mmHg
Melting Point:	83 °C
Purity:	≥ 98 %, ≥ 95 % e.e.
Density:	1.106 g/cm³
Solubility:	Insoluble in water.
Appearance:	White crystalline powder
Storage:	Inert atmosphere. Keep cold.
MDL:	MFCD00082751
LogP:	3.78700

GHS Hazard Statement:	H315 (91.67%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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PMID	Publication Date	Title	Journal
22717593	20120807	A tripeptide-like prolinamide-thiourea as an aldol reaction catalyst	Organic & biomolecular chemistry
22166917	20120214	The effects of ligand variation on enantioselective hydrogenation catalysed by RuH2(diphosphine)(diamine) complexes	Dalton transactions (Cambridge, England : 2003)
22185511	20120120	Construction of tertiary alcohols bearing perfluoroalkyl chains catalyzed by prolinamide-thioureas	The Journal of organic chemistry
21575933	20110906	Preparation of 1-C-glycosyl aldehydes by reductive hydrolysis	Carbohydrate research
21298140	20110407	Interplay between the diamine structure and absolute helicity in Ni-salen metallofoldamers	Chemical communications (Cambridge, England)

Complexity:	171
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	2
Defined Bond Stereocenter Count:	0
Exact Mass:	212.131348519
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	212.131348519
Rotatable Bond Count:	3
Topological Polar Surface Area:	52 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4