[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine

C9H20N2O3S — CID 105321290

IUPAC[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine
SMILESCCOCC(NN)C1CCCCS1(=O)=O
InChIInChI=1S/C9H20N2O3S/c1-2-14-7-8(11-10)9-5-3-4-6-15(9,12)13/h8-9,11H,2-7,10H2,1H3
InChIKeyCEMXRYLFWSGCDO-UHFFFAOYSA-N
MW236.34 g/mol
LogP-0.18
Rot. Bonds5

About [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine

[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine (PubChem CID 105321290) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine
PubChem CID105321290
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC Name[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine
SMILESCCOCC(NN)C1CCCCS1(=O)=O
InChIInChI=1S/C9H20N2O3S/c1-2-14-7-8(11-10)9-5-3-4-6-15(9,12)13/h8-9,11H,2-7,10H2,1H3
InChIKeyCEMXRYLFWSGCDO-UHFFFAOYSA-N
XLogP-0.18
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(1,1-dioxothian-2-yl)-2-propoxyethyl]hydrazine
CID 105321488
1-(1,1-dioxothian-2-yl)-2-ethoxy-N-methylethanamine
CID 105008079
[1-(1,1-dioxothian-2-yl)-2-phenylethyl]hydrazine
CID 105283171
[2-ethoxy-1-(oxolan-2-yl)ethyl]hydrazine
CID 105229017
[2-(4-chlorophenyl)-1-(1,1-dioxothian-2-yl)ethyl]hydrazine
CID 105283336
1-(1,1-dioxothian-2-yl)-N-methyldecan-1-amine
CID 115831653
[1-(1,1-dioxothian-2-yl)-2-(2-methoxy-5-methylphenyl)ethyl]hydrazine
CID 105292010
1-(1,1-dioxothian-2-yl)-2-methylbutan-1-ol
CID 115823354
1-(1,1-dioxothian-2-yl)-N-ethyloctan-1-amine
CID 115832238
1-(1,1-dioxothian-2-yl)-N-methylbut-3-yn-1-amine
CID 114977650
[1-(2,2-dimethylcyclopentyl)-2-ethoxyethyl]hydrazine
CID 107194346
(1-cycloheptyl-4-ethoxybutyl)hydrazine
CID 105330658

Frequently Asked Questions

What is the IUPAC name of [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine?
The IUPAC name of [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine (CID 105321290) is [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine.
What is the SMILES notation for [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine?
The canonical SMILES for [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine is CCOCC(NN)C1CCCCS1(=O)=O.
What is the InChIKey of [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine?
The InChIKey is CEMXRYLFWSGCDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-2-14-7-8(11-10)9-5-3-4-6-15(9,12)13/h8-9,11H,2-7,10H2,1H3.
What are the key properties of [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine?
[1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine has a molecular weight of 236.34 g/mol, XLogP of -0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1,1-dioxothian-2-yl)-2-ethoxyethyl]hydrazine is sourced from PubChem (CID 105321290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).