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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

Heptanal, 7-(acetyloxy)-

O=CCCCCCCOC(=O)C Request for Quotation
Chemical Name: Heptanal, 7-(acetyloxy)-
CAS Number: 29425-54-5
Product Number: AG002YCD(AGN-PC-0NCUQ0)
Synonyms:
MDL No:
Molecular Formula: C9H16O3
Molecular Weight: 172.2215

Identification/Properties

Properties
Form:
Liquid
Computed Properties
Molecular Weight:
172.224g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
8
Exact Mass:
172.11g/mol
Monoisotopic Mass:
172.11g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
132
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


7-Oxoheptyl acetate, also known as heptan-2-one oxime, is a versatile chemical compound widely used in various chemical synthesis applications. This compound serves as a key intermediate in the production of a variety of compounds with diverse functionalities due to its unique chemical properties. In chemical synthesis, 7-Oxoheptyl acetate acts as a valuable building block for the creation of different derivatives through various transformation reactions.One of the prominent applications of 7-Oxoheptyl acetate in chemical synthesis is in the preparation of fragrances and flavor compounds. Its chemical structure and reactivity make it a suitable precursor for the synthesis of esters and ketones that contribute to the aroma and taste of consumer products like perfumes, cosmetics, and food additives. By undergoing specific chemical reactions, 7-Oxoheptyl acetate can be transformed into a range of fragrance molecules with desirable olfactory characteristics.Additionally, 7-Oxoheptyl acetate finds utility in the pharmaceutical industry for the synthesis of bioactive compounds and pharmaceutical intermediates. Through controlled chemical reactions, this compound can be converted into structurally complex molecules with potential therapeutic properties. Its incorporation into synthesis routes allows for the creation of novel drug candidates and active pharmaceutical ingredients, contributing to advancements in medicine and healthcare.Moreover, the versatile nature of 7-Oxoheptyl acetate enables its use in the preparation of specialty chemicals and fine chemicals. By leveraging its chemical reactivity and functional groups, chemists can manipulate its structure to yield a diverse array of specialty compounds used in various industrial applications. This compound serves as a valuable tool for organic chemists and researchers seeking to develop new materials, dyes, and intermediates for a wide range of industrial processes.