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3,3-bis(chloromethyl)oxetane: retrosynthesis target

3,3-bis(chloromethyl)oxetane presents a C5 framework, halogen substitution (formula C5H8Cl2O, CAS 78-71-7). ChemicalTool Reaction can propose ranked disconnections for 3,3-bis(chloromethyl)oxetane from the SMILES ClCC1(CCl)COC1.

Target
3,3-bis(chloromethyl)oxetane
CAS
78-71-7
Formula
C5H8Cl2O
Approx. MW
155.02
SMILES
ClCC1(CCl)COC1
PubChem CID
6550
Approx. carbons
C5

3,3-bis(chloromethyl)oxetane structure

Properties

IUPAC name
3,3-bis(chloromethyl)oxetane
Common names
3,3-Bis(chloromethyl)oxetane; 78-71-7; OXETANE, 3,3-BIS(CHLOROMETHYL)-; Penton; 3,3-Dichloromethyloxycyclobutane; HSDB 6322; EINECS 201-136-5; N12TP81ATK; BRN 0103354; 3,3-bis(chloromethyl)oxacyclobutane
Molecular weight
155.02
Exact mass
154.00
InChIKey
CXURGFRDGROIKG-UHFFFAOYSA-N
Melting point
66 °F (EPA, 1998)
Boiling point
217 °F at 30 mmHg (EPA, 1998)
Density
1.4

View on PubChem

3,3-bis(chloromethyl)oxetane 1H / 13C NMR spectrum →

FAQ

What is the chemical formula of 3,3-bis(chloromethyl)oxetane?

3,3-bis(chloromethyl)oxetane has molecular formula C5H8Cl2O. Molecular weight about 155.02 g·mol⁻¹.

What is the CAS number of 3,3-bis(chloromethyl)oxetane?

The CAS Registry Number for 3,3-bis(chloromethyl)oxetane is 78-71-7.

Run AI retrosynthesis for 3,3-bis(chloromethyl)oxetane Target catalog AI tools overview

Open the planner with 3,3-bis(chloromethyl)oxetane preloaded, then keep routes that match CAS 78-71-7.

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3-Chloropivaloyl chloride(RS)-2-Methylbutyryl chloride1-Bromo-3-Methylbutane1-Bromo-5-chloropentane1-Bromopentane1-Chloro-3-Methylbutane

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References & tools