Ethyl 4-aminocinnamate - CAS 5048-82-8

Name: Ethyl 4-aminocinnamate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB027077
Product Name:	Ethyl 4-aminocinnamate
CAS:	5048-82-8
Synonyms:	ethyl (E)-3-(4-aminophenyl)prop-2-enoate

Technical Data

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Patents

Computed Properties

IUPAC Name:	ethyl (E)-3-(4-aminophenyl)prop-2-enoate
Description:	Ethyl 4-aminocinnamate (CAS# 5048-82-8) is a useful research chemical.
Molecular Weight:	191.23
Molecular Formula:	C11H13NO2
Canonical SMILES:	CCOC(=O)C=CC1=CC=C(C=C1)N
InChI:	InChI=1S/C11H13NO2/c1-2-14-11(13)8-5-9-3-6-10(12)7-4-9/h3-8H,2,12H2,1H3/b8-5+
InChI Key:	NRPMBSHHBFFYBF-VMPITWQZSA-N
Boiling Point:	347 °C at 760 mmHg
Melting Point:	70-74 °C
Purity:	99+ %
Density:	1.13 g/cm³
Solubility:	Insoluble in water
Appearance:	Slight yellow or off white crystalline
MDL:	MFCD00017116
LogP:	2.42630

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Related Functional Groups

Carbonyl Compounds

[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[438616-66-1]C14H20N2O
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide
[104496-91-5]C7H9N3OS
2-(Pyridin-2-ylthio)acetohydrazide

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

Publication Number	Title	Priority Date
WO-2019051207-A1	PROXISOME PROLIFER ACTIVATED RECEPTOR (PPAR) AGONIST ANALOGS AND METHODS OF USING THE SAME	20170908
JP-2020503169-A	Nitrogen-containing biopolymer-based catalysts, methods for their preparation and their use in hydrogenation processes, reductive dehalogenation, and oxidation	20161219
US-2019381485-A1	Nitrogen containing biopolymer-based catalysts, a process for their preparation and uses thereof	20161219
WO-2018114777-A1	Nitrogen-containing biopolymer-based catalysts, their preparation and uses in hydrogenation processes, reductive dehalogenation and oxidation	20161219
EP-3413866-A1	Moisturizing personal care compositions comprising monodisperse phytoglycogen nanoparticles and a further polysaccharide	20160208

Complexity:	205
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	191.094628657
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.094628657
Rotatable Bond Count:	4
Topological Polar Surface Area:	52.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3