N,N,N'-Trimethyl-1,3-propanediamine - CAS 4543-96-8

Catalog:	BB025866
Product Name:	N,N,N'-Trimethyl-1,3-propanediamine
CAS:	4543-96-8
Synonyms:	N,N',N'-trimethylpropane-1,3-diamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	N,N',N'-trimethylpropane-1,3-diamine
Description:	N,N,N'-Trimethyl-1,3-propanediamine (CAS# 4543-96-8) is a reactant that as a ligand, racemizes aromatic alcohols completely in the prescence of a ruthenium-based racemization catalyst.
Molecular Weight:	116.20
Molecular Formula:	C6H16N2
Canonical SMILES:	CNCCCN(C)C
InChI:	InChI=1S/C6H16N2/c1-7-5-4-6-8(2)3/h7H,4-6H2,1-3H3
InChI Key:	SORARJZLMNRBAQ-UHFFFAOYSA-N
Boiling Point:	140-142 °C
Density:	0.793 g/cm³
MDL:	MFCD00014879
LogP:	0.54840

Publication Number	Title	Priority Date
CN-112374995-A	Synthesis method of polybasic tertiary amine	20201130
CN-112479892-A	Methylation method of polymethine propane diamine	20201130
CN-111100161-A	Magnetic nano composite material for ATRP reaction and preparation method thereof	20191224
KR-20210077527-A	CONVERSION COATING COMPOSITION FOR Zn-Al-Mg ALLOY PLATED STEEL SHEET AND Zn-Al-Mg ALLOY PLATED STEEL SHEET	20191217
WO-2021125830-A1	Conversion coating composition for zn-al-mg alloy plated steel sheet and zn-al-mg alloy plated steel sheet	20191217

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Related Functional Groups

Nitrogen Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[62838-59-9]
1-Cyclopentyl-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile
[618-40-6]
1-Methyl-1-phenylhydrazine
[514801-07-1]
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
[7492-88-8]
3-piperidinecarbonitrile

GHS Hazard Statement:	H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
Precautionary Statement:	P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P370+P378, P403+P235, P405, and P501
Signal Word:	Danger

Complexity:	43.8
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	116.131348519
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	116.131348519
Rotatable Bond Count:	4
Topological Polar Surface Area:	15.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2