2-Ethoxybenzaldehyde - CAS 613-69-4

Catalog:	BB031076
Product Name:	2-Ethoxybenzaldehyde
CAS:	613-69-4
Synonyms:	2-ethoxybenzaldehyde

Technical Data

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Computed Properties

IUPAC Name:	2-ethoxybenzaldehyde
Description:	2-Ethoxybenzaldehyde (CAS# 613-69-4) is a useful research chemical.
Molecular Weight:	150.17
Molecular Formula:	C9H10O2
Canonical SMILES:	CCOC1=CC=CC=C1C=O
InChI:	InChI=1S/C9H10O2/c1-2-11-9-6-4-3-5-8(9)7-10/h3-7H,2H2,1H3
InChI Key:	DUVJMSPTZMCSTQ-UHFFFAOYSA-N
Boiling Point:	136-138 °C (24 mmHg)
Density:	1.074 g/cm³
MDL:	MFCD00003316
LogP:	1.89780

Publication Number	Title	Priority Date
CN-113480723-A	Complex catalyst for synthesizing polycarbonate-based degradable plastic and application thereof	20210719
CN-111675626-A	Ionone alkaloid derivative and medical application thereof	20200319
DE-102019218788-A1	Multi-tonal hair coloring process in three steps	20191203
WO-2021110306-A1	Multi-tone hair dyeing method in three steps	20191203
WO-2021076944-A1	Methods and compositions for scavenging sulfides from hydrocarbon fluids and aqueous streams	20191017

PMID	Publication Date	Title	Journal
21754845	20110601	2,4-Bis(2-eth-oxy-phen-yl)-7-methyl-3-aza-bicyclo-[3.3.1]nonan-9-one	Acta crystallographica. Section E, Structure reports online
21375334	20110414	Design, synthesis, and structure-activity relationship exploration of 1-substituted 4-aroyl-3-hydroxy-5-phenyl-1H-pyrrol-2(5H)-one analogues as inhibitors of the annexin A2-S100A10 protein interaction	Journal of medicinal chemistry

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
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[51493-02-8]
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[959574-98-2]
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[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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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:	123
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	150.068079557
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	150.068079557
Rotatable Bond Count:	3
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1