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Structure

5-Amino-2-bromobenzotrifluoride

CAS
393-36-2
Catalog Number
ACM393362
Category
Bromine Series
Molecular Weight
240.02

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Specification

Hazard Statements
H315-H319-H335
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of the compound?

The molecular formula is C7H5BrF3N.

What is the molecular weight of the compound?

The molecular weight is 240.02 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 4-bromo-3-(trifluoromethyl)aniline.

What is the InChI of the compound?

The InChI is InChI=1S/C7H5BrF3N/c8-6-2-1-4(12)3-5(6)7(9,10)11/h1-3H,12H2.

What is the InChIKey of the compound?

The InChIKey is YGNISOAUPSJDJE-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is C1=CC(=C(C=C1N)C(F)(F)F)Br.

What is the CAS number of the compound?

The CAS number is 393-36-2.

What is the European Community (EC) number of the compound?

The European Community (EC) number is 206-885-1.

What is the DSSTox Substance ID of the compound?

The DSSTox Substance ID is DTXSID50192540.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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