1,3-dioxolan-2-one;methoxymethane;hydrochloride

C5H11ClO4 — CID 173350365

IUPAC1,3-dioxolan-2-one;methoxymethane;hydrochloride
SMILESCOC.Cl.O=C1OCCO1
InChIInChI=1S/C3H4O3.C2H6O.ClH/c4-3-5-1-2-6-3;1-3-2;/h1-2H2;1-2H3;1H
InChIKeyOMVUIDAKVZNSQQ-UHFFFAOYSA-N
MW170.59 g/mol
LogP0.84
Rot. Bonds

About 1,3-dioxolan-2-one;methoxymethane;hydrochloride

1,3-dioxolan-2-one;methoxymethane;hydrochloride (PubChem CID 173350365) has the molecular formula C5H11ClO4 and a molecular weight of 170.59 g/mol. Its IUPAC name is 1,3-dioxolan-2-one;methoxymethane;hydrochloride.

Molecular Properties

Compound Name1,3-dioxolan-2-one;methoxymethane;hydrochloride
PubChem CID173350365
Molecular FormulaC5H11ClO4
Molecular Weight170.59 g/mol
Exact Mass170.03
IUPAC Name1,3-dioxolan-2-one;methoxymethane;hydrochloride
SMILESCOC.Cl.O=C1OCCO1
InChIInChI=1S/C3H4O3.C2H6O.ClH/c4-3-5-1-2-6-3;1-3-2;/h1-2H2;1-2H3;1H
InChIKeyOMVUIDAKVZNSQQ-UHFFFAOYSA-N
XLogP0.84
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.59
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1,3-dioxolan-2-one;methoxymethane;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1,3-dioxolan-2-one
CID 7303
1,3-dioxolan-2-one;ethane;propane
CID 91581016
acetonitrile;1,3-dioxolan-2-one
CID 69295192
1,3,8,10-tetraoxacyclotetradecane-2,9-dione
CID 67254769
1,3-dioxolan-2-one;heptane
CID 174901470
lithium;1,3-dioxolan-2-one;hexafluorophosphate
CID 146442279
1,3-dioxolane;1,3-dioxolan-2-one
CID 160802648
adamantane;1,3-dioxolan-2-one
CID 175094584
N,N-dimethylacetamide;1,3-dioxolan-2-one
CID 158215912
1,3-dioxacyclotetradecan-2-one
CID 22011560
1,3-dioxolan-2-one;pyrrolidine-2,5-dione
CID 66849817
trilithium;1,3-dioxolan-2-one;phosphate
CID 174955096

Frequently Asked Questions

What is the IUPAC name of 1,3-dioxolan-2-one;methoxymethane;hydrochloride?
The IUPAC name of 1,3-dioxolan-2-one;methoxymethane;hydrochloride (CID 173350365) is 1,3-dioxolan-2-one;methoxymethane;hydrochloride.
What is the SMILES notation for 1,3-dioxolan-2-one;methoxymethane;hydrochloride?
The canonical SMILES for 1,3-dioxolan-2-one;methoxymethane;hydrochloride is COC.Cl.O=C1OCCO1.
What is the InChIKey of 1,3-dioxolan-2-one;methoxymethane;hydrochloride?
The InChIKey is OMVUIDAKVZNSQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4O3.C2H6O.ClH/c4-3-5-1-2-6-3;1-3-2;/h1-2H2;1-2H3;1H.
What are the key properties of 1,3-dioxolan-2-one;methoxymethane;hydrochloride?
1,3-dioxolan-2-one;methoxymethane;hydrochloride has a molecular weight of 170.59 g/mol, XLogP of 0.84, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dioxolan-2-one;methoxymethane;hydrochloride is sourced from PubChem (CID 173350365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).