4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol

C11H22O5 — CID 22983114

IUPAC4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol
SMILESCOCC(OC)C1CC(O)C(OC)C1OC
InChIInChI=1S/C11H22O5/c1-13-6-9(14-2)7-5-8(12)11(16-4)10(7)15-3/h7-12H,5-6H2,1-4H3
InChIKeyZTBVYCPOGJTIKA-UHFFFAOYSA-N
MW234.29 g/mol
LogP0.06
Rot. Bonds6

About 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol

4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol (PubChem CID 22983114) has the molecular formula C11H22O5 and a molecular weight of 234.29 g/mol. Its IUPAC name is 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol.

Molecular Properties

Compound Name4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol
PubChem CID22983114
Molecular FormulaC11H22O5
Molecular Weight234.29 g/mol
Exact Mass234.15
IUPAC Name4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol
SMILESCOCC(OC)C1CC(O)C(OC)C1OC
InChIInChI=1S/C11H22O5/c1-13-6-9(14-2)7-5-8(12)11(16-4)10(7)15-3/h7-12H,5-6H2,1-4H3
InChIKeyZTBVYCPOGJTIKA-UHFFFAOYSA-N
XLogP0.06
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.29
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol?
The IUPAC name of 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol (CID 22983114) is 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol.
What is the SMILES notation for 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol?
The canonical SMILES for 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol is COCC(OC)C1CC(O)C(OC)C1OC.
What is the InChIKey of 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol?
The InChIKey is ZTBVYCPOGJTIKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O5/c1-13-6-9(14-2)7-5-8(12)11(16-4)10(7)15-3/h7-12H,5-6H2,1-4H3.
What are the key properties of 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol?
4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol has a molecular weight of 234.29 g/mol, XLogP of 0.06, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2-dimethoxyethyl)-2,3-dimethoxycyclopentan-1-ol is sourced from PubChem (CID 22983114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).