4-Ethylsalicylaldehyde - CAS 161876-64-8

Catalog:	BB011794
Product Name:	4-Ethylsalicylaldehyde
CAS:	161876-64-8
Synonyms:	4-ethyl-2-hydroxybenzaldehyde; 4-ethyl-2-hydroxybenzaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	4-ethyl-2-hydroxybenzaldehyde
Description:	4-Ethylsalicylaldehyde (CAS# 161876-64-8 ) is a useful research chemical.
Molecular Weight:	150.17
Molecular Formula:	C9H10O2
Canonical SMILES:	CCC1=CC(=C(C=C1)C=O)O
InChI:	InChI=1S/C9H10O2/c1-2-7-3-4-8(6-10)9(11)5-7/h3-6,11H,2H2,1H3
InChI Key:	GHKLSRUKZUYUAD-UHFFFAOYSA-N
LogP:	1.76710

Publication Number	Title	Priority Date
CN-110041227-B	Preparation of bimetallic Schiff base Mo complex and application of bimetallic Schiff base Mo complex in catalyzing olefin epoxidation	20190524
TW-202010742-A	Substituted benzofuran, benzopyrrole,benzothiophene, and structurally related complement inhibitors	20180406
US-2019345135-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406
WO-2019195720-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406
AU-2019247471-A1	Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors	20180406

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Complexity:	134
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:	1
Isotope Atom Count:	0
Monoisotopic Mass:	150.068079557
Rotatable Bond Count:	2
Topological Polar Surface Area:	37.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4