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1,1-Diethoxycyclopentane

HCID 90268
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Basic information

CAS
23786-93-8
Standard SMILES
CCOC1(OCC)CCCC1
InChIKey
QJKUIUCQENFWSS-UHFFFAOYSA-N
Molecular formula
C9H18O2
Average molar mass
158.24 g/mol
Monoisotopic mass
158.13067981

Overview

See also: silicic acid (h2sio3), sodium zinc salt (annotation moved to).

Names & identifiers

Preferred name
1,1-Diethoxycyclopentane
IUPAC
1,1-diethoxycyclopentane
English name
1,1-diethoxycyclopentane
Molecular formula
C9H18O2
Molecular weight
158.24

Names & synonyms

1,1-Diethoxycyclopentane23786-93-8Cyclopentane, 1,1-diethoxy-EINECS 245-888-2BU0U0V23NMUNII-BU0U0V23NMDTXSID40178474RefChem:71067DTXCID70100965245-888-2Cyclopentane,1,1-diethoxy-Cyclopentanone, Diethyl Acetal; 1,1-Diethoxycyclopentane; Cyclopentanone Diethyl Ketal
Show more names
Cyclopentanone diethyl acetal1-Cyclopentanone diethyl acetal
starbld0001243Sodium zinc metasilicate1,1-diethoxy-cyclopentaneSCHEMBL732380QJKUIUCQENFWSS-UHFFFAOYSA-NAKOS028110934NS00027485

Database identifiers

CAS
23786-93-8
PubChem CID
90268
DTXSID
DTXSID40178474
UNII
BU0U0V23NM
EC Number
245-888-2
Nikkaji
J242.682J

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
11
Formal charge
0
Complexity
98.1

Physicochemical properties

form
Oil
color
Colourless
FDA UNII
0 U0V23NM · BU0U0V23NM

Chemistry & industry

Applications

Uses1,1-Diethoxycyclopentane is a reagent that is used in the synthesis of Quinbolone (Q670150), which is a cyclopentenyl ether derivative of Boldenone (B675100) and also its active metabolite. Quinbolone shows weak androgenic activity.

Related reactions

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Compound notes

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