4-Tetradecylaniline - CAS 91323-12-5

Catalog:	BB040118
Product Name:	4-Tetradecylaniline
CAS:	91323-12-5
Synonyms:	4-tetradecylaniline

Technical Data

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Computed Properties

IUPAC Name:	4-tetradecylaniline
Description:	4-Tetradecylaniline (CAS# 91323-12-5) is a useful research chemical.
Molecular Weight:	289.50
Molecular Formula:	C20H35N
Canonical SMILES:	CCCCCCCCCCCCCCC1=CC=C(C=C1)N
InChI:	InChI=1S/C20H35N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-15-17-20(21)18-16-19/h15-18H,2-14,21H2,1H3
InChI Key:	WKYFQPQIOXXPGE-UHFFFAOYSA-N
Boiling Point:	408 °C at 760 mmHg
Melting Point:	46-47 °C
Purity:	95 %
Density:	0.897 g/cm³
MDL:	MFCD00009804
LogP:	7.09360

Publication Number	Title	Priority Date
CN-112480408-A	Synthetic method and application of PASP derivative with surface activity	20201202
CN-112280251-A	High-performance amine curing system epoxy asphalt material and preparation method thereof	20201124
CN-109320439-A	A kind of N '-(4- alkane phenyl)-N, the synthesis separation method of N- dimethylamidine	20181029
CN-109320439-B	Synthesis and separation method of N' - (4-alkylphenyl) -N, N-dimethylamidine	20181029
CN-112029116-A	Preparation method of emulsified modified asphalt based on zwitterionic Gemini emulsifier	20180405

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GHS Hazard Statement:	H315 (100%): 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

Complexity:	206
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	289.276950121
Formal Charge:	0
Heavy Atom Count:	21
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	289.276950121
Rotatable Bond Count:	13
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	8.3