CAS
948552-24-7 Purity
95%+
948552-24-7 Purity
95%+
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4-(Bromomethyl)-3-(Trifluoromethyl)benzoyl Chloride
CAS
948553-14-8
Catalog Number
ACM948553148
Category
Other Products
Molecular Weight
301.49
Molecular Formula
C9H5OBrClF3
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Specification
Synonyms
4-Bromomethyl-3-trifluoromethylbenzoyl chloride
What is the molecular formula of 4-(Bromomethyl)-3-(Trifluoromethyl)benzoyl Chloride?
The molecular formula is C9H5BrClF3O.
When was this compound created?
It was created on January 22, 2009.
What is the molecular weight of 4-(Bromomethyl)-3-(Trifluoromethyl)benzoyl Chloride?
The molecular weight is 301.49 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 4-(bromomethyl)-3-(trifluoromethyl)benzoyl chloride.
What is the Canonical SMILES representation of the compound?
The Canonical SMILES is C1=CC(=C(C=C1C(=O)Cl)C(F)(F)F)CBr.
What is the InChIKey of the compound?
The InChIKey is KDBGNVBIKFJPKS-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts does the compound have?
The compound has 4 hydrogen bond acceptor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 17.1 Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 3.9.
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948554-96-9 Purity
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