Benzyl 3,3-difluorocyclobutanecarboxylate

• CAS: 935273-86-2
• Catalog Number: ACM935273862
• Category: Other Products
• Molecular Weight: 226.219286 [g/mol]
• Molecular Formula: C₁₂H₁₂F₂O₂
• Synonyms: Benzyl 3,3-difluorocyclobutanecarboxylate, 935273-86-2, SureCN2209386, RL05871, AK132723, KB-47757, M112308
• IUPAC Name: benzyl 3,3-difluorocyclobutane-1-carboxylate
• InChI Key: RRSMHVQRSRIXGF-UHFFFAOYSA-N
• Exact Mass: 226.08100
• H-Bond Acceptor: 4
• H-Bond Donor: 0

Custom Q&A

What is the molecular formula of Benzyl 3,3-difluorocyclobutanecarboxylate?

The molecular formula of Benzyl 3,3-difluorocyclobutanecarboxylate is C12H12F2O2.

What is the molecular weight of Benzyl 3,3-difluorocyclobutanecarboxylate?

The molecular weight of Benzyl 3,3-difluorocyclobutanecarboxylate is 226.22 g/mol.

What is the IUPAC name of Benzyl 3,3-difluorocyclobutanecarboxylate?

The IUPAC name of Benzyl 3,3-difluorocyclobutanecarboxylate is benzyl 3,3-difluorocyclobutane-1-carboxylate.

What is the InChI of Benzyl 3,3-difluorocyclobutanecarboxylate?

The InChI of Benzyl 3,3-difluorocyclobutanecarboxylate is InChI=1S/C12H12F2O2/c13-12(14)6-10(7-12)11(15)16-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2.

What is the InChIKey of Benzyl 3,3-difluorocyclobutanecarboxylate?

The InChIKey of Benzyl 3,3-difluorocyclobutanecarboxylate is RRSMHVQRSRIXGF-UHFFFAOYSA-N.

What is the canonical SMILES of Benzyl 3,3-difluorocyclobutanecarboxylate?

The canonical SMILES of Benzyl 3,3-difluorocyclobutanecarboxylate is C1C(CC1(F)F)C(=O)OCC2=CC=CC=C2.

What is the CAS number of Benzyl 3,3-difluorocyclobutanecarboxylate?

The CAS number of Benzyl 3,3-difluorocyclobutanecarboxylate is 935273-86-2.

What is the DSSTox Substance ID of Benzyl 3,3-difluorocyclobutanecarboxylate?

The DSSTox Substance ID of Benzyl 3,3-difluorocyclobutanecarboxylate is DTXSID20717784.

What is the XLogP3-AA value of Benzyl 3,3-difluorocyclobutanecarboxylate?

The XLogP3-AA value of Benzyl 3,3-difluorocyclobutanecarboxylate is 2.7.

Is the compound Benzyl 3,3-difluorocyclobutanecarboxylate canonicalized?

Yes, the compound Benzyl 3,3-difluorocyclobutanecarboxylate is canonicalized.