N,N-Diethylaniline-4-D - CAS 2065185-74-0

Name: N,N-Diethylaniline-4-D
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB016128
Product Name:	N,N-Diethylaniline-4-D
CAS:	2065185-74-0
Synonyms:	N,N-diethylaniline; N,N-diethylaniline

Technical Data

IUPAC Name:	N,N-diethylaniline
Description:	N,N-Diethylaniline-4-D (CAS# 2065185-74-0 ) is a useful research chemical.
Molecular Weight:	150.24
Molecular Formula:	C10H14ND
Canonical SMILES:	CCN(CC)C1=CC=CC=C1
InChI:	InChI=1S/C10H15N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3
InChI Key:	GGSUCNLOZRCGPQ-UHFFFAOYSA-N
Boiling Point:	419.9 °F at 760 mmHg; 198 °F at 10 mmHg\|
Melting Point:	-37.8 °F
Flash Point:	185 °F
Density:	0.906
Solubility:	less than 1 mg/mL at 76.1 °F
Appearance:	Colorless to yellow liquid
Decomposition:	When heated to decomposition it emits toxic fumes of nitroxides
Vapor Pressure:	1 mmHg at 121.5 °F

GHS Hazard Statement:	H301: Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P260, P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P311, P312, P314, P321, P322, P330, P361, P363, P391, P403+P233, P405, and P501
Signal Word:	Danger

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PMID	Publication Date	Title	Journal
22706519	20120807	Charge-transfer guest interactions in luminescent MOFs: implications for solid-state temperature and environmental sensing	Dalton transactions (Cambridge, England : 2003)
22504830	20120413	Selective formation of twisted intramolecular charge transfer and excimer emissions on 2,7-bis(4-diethylaminophenyl)-fluorenone by choice of solvent	Molecules (Basel, Switzerland)
22018853	20120410	Dust as a collection media for contaminant source attribution	Forensic science international
22137011	20120201	Photoactive azoimine dyes: 4-(2-pyridylazo)-N,N-diethylaniline and 4-(2-pyridylazo)-N,N-dimethylaniline: computational and experimental investigation	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy
22036316	20120101	Metal-enhanced fluorescence exciplex emission	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy

Complexity:	91
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	149.120449483
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	149.120449483
Rotatable Bond Count:	3
Topological Polar Surface Area:	3.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3