Ethyl 2-Acetylhexanoate - CAS 1540-29-0

Catalog:	BB010965
Product Name:	Ethyl 2-Acetylhexanoate
CAS:	1540-29-0
Synonyms:	2-acetylhexanoic acid ethyl ester; ethyl 2-acetylhexanoate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 2-acetylhexanoate
Description:	Ethyl 2-Acetylhexanoate can be used as polymer photographic color images.
Molecular Weight:	186.25
Molecular Formula:	C10H18O3
Canonical SMILES:	CCCCC(C(=O)C)C(=O)OCC
InChI:	InChI=1S/C10H18O3/c1-4-6-7-9(8(3)11)10(12)13-5-2/h9H,4-7H2,1-3H3
InChI Key:	ZTOQBHVLCJERBS-UHFFFAOYSA-N
Boiling Point:	65 °C 1 mmHg, 221.5 °C at 760 mmHg
Density:	0.95 g/cm³
Solubility:	Practically insoluble or insoluble in water
Appearance:	Colorless liquid
MDL:	MFCD00026888
LogP:	1.94490

Publication Number	Title	Priority Date
CN-111978262-A	Synthetic method of hydroxypyrimidine compound	20200806
US-2021171870-A1	Detergent composition comprising an inverse latex comprising a particular sequestrant and a polyelectrolyte combining a strong acid function and a weak acid function	20191209
US-2021171871-A1	Detergent composition comprising an inverse latex combining edds as sequestrant and a polyelectrolyte comprising amps and acrylamide	20191209
US-2021171872-A1	Detergent composition comprising an inverse latex combining glutamic acid, n,n-diacetic acid, tetrasodium salt as sequestrant and a polyelectrolyte comprising amps and acrylamide	20191209
US-2021171873-A1	Detergent composition comprising an inverse latex combining a particular sequestrant and a polyelectrolyte comprising a strong acid function and a neutral function	20191209

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Complexity:	175
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	186.125594432
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	186.125594432
Rotatable Bond Count:	7
Topological Polar Surface Area:	43.4
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3