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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)-

methyl 2-(4-hydroxycyclohexyl)acetate

COC(=O)CC1CCC(CC1)O Request for Quotation
Chemical Name: methyl 2-(4-hydroxycyclohexyl)acetate
CAS Number: 99183-13-8
Product Number: AG00IK8J(AGN-PC-0NJXYT)
Synonyms:
MDL No:
Molecular Formula: C9H16O3
Molecular Weight: 172.2215

Identification/Properties

Computed Properties
Molecular Weight:
172.224g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
172.11g/mol
Monoisotopic Mass:
172.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
148
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

GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H227-H315-H319-H335
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 2-(4-hydroxycyclohexyl)acetate is a versatile compound commonly utilized in chemical synthesis processes. This compound serves as a valuable building block in the creation of various organic molecules due to its unique structure and reactivity. In chemical synthesis, Methyl 2-(4-hydroxycyclohexyl)acetate can be employed as a key intermediate in the production of pharmaceuticals, fragrances, and agrochemicals. Its functional groups enable it to participate in a wide range of reactions, allowing chemists to modify and transform its structure to tailor its properties for specific applications. Additionally, the presence of the hydroxyl group and the cyclohexyl ring in this compound provides opportunities for further functionalization, making it a valuable asset in the synthesis of complex organic compounds with diverse functionalities and applications.