Benzyl 2,2,2-trichloroacetimidate

• CAS: 81927-55-1
• Catalog Number: ACM81927551
• Category: Benzylation (Bn) Reagents
• Molecular Weight: 252.52
• Molecular Formula: C9H8Cl3NO
• Synonyms: 2,2,2-Trichloroacetimidic acid benzyl ester
• IUPAC Name: phenylmethyl 2,2,2-trichloroethanimidate
• Canonical SMILES: C1=CC=C(C=C1)COC(=N)C(Cl)(Cl)Cl
• InChI Key: HUZCTWYDQIQZPM-UHFFFAOYSA-N
• Boiling Point: 106-114 °C
• Flash Point: >230 °F
• Density: 1.359 g/mL at 25 °C (lit.)
• Appearance: clear colorless to yellow liquid
• EC Number: 617-271-1
• Exact Mass: 250.96700
• Hazard Statements: H318
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Physical State: Liquid
• RIDADR: NONH for all modes of transport
• Safety Description: S26-S37/39
• Symbol: GHS05
• WGK Germany: 3

Custom Q&A

What is the molecular formula of Benzyl 2,2,2-trichloroacetimidate?

The molecular formula of Benzyl 2,2,2-trichloroacetimidate is C9H8Cl3NO.

What is the molecular weight of Benzyl 2,2,2-trichloroacetimidate?

The molecular weight of Benzyl 2,2,2-trichloroacetimidate is 252.5 g/mol.

When was Benzyl 2,2,2-trichloroacetimidate created?

Benzyl 2,2,2-trichloroacetimidate was created on March 27, 2005.

What is the IUPAC name of Benzyl 2,2,2-trichloroacetimidate?

The IUPAC name of Benzyl 2,2,2-trichloroacetimidate is benzyl 2,2,2-trichloroethanimidate.

What is the InChIKey of Benzyl 2,2,2-trichloroacetimidate?

The InChIKey of Benzyl 2,2,2-trichloroacetimidate is HUZCTWYDQIQZPM-UHFFFAOYSA-N.

What is the CAS number of Benzyl 2,2,2-trichloroacetimidate?

The CAS number of Benzyl 2,2,2-trichloroacetimidate is 81927-55-1.

How many hydrogen bond donor atoms are there in Benzyl 2,2,2-trichloroacetimidate?

There is 1 hydrogen bond donor atom in Benzyl 2,2,2-trichloroacetimidate.

How many hydrogen bond acceptor atoms are there in Benzyl 2,2,2-trichloroacetimidate?

There are 2 hydrogen bond acceptor atoms in Benzyl 2,2,2-trichloroacetimidate.

What is the topological polar surface area of Benzyl 2,2,2-trichloroacetimidate?

The topological polar surface area of Benzyl 2,2,2-trichloroacetimidate is 33.1Ų.

Is Benzyl 2,2,2-trichloroacetimidate a canonicalized compound?

Yes, Benzyl 2,2,2-trichloroacetimidate is a canonicalized compound.