CAS
201849-18-5 Purity
97%
201849-18-5 Purity
97%
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3-Bromo-5-(trifluoromethyl)anisole
CAS
627527-23-5
Catalog Number
ACM627527235
Category
Bromine Series
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What is the molecular formula of 3-Bromo-5-(trifluoromethyl)anisole?
The molecular formula is C8H6BrF3O.
What is the IUPAC name of 3-Bromo-5-(trifluoromethyl)anisole?
The IUPAC name is 1-bromo-3-methoxy-5-(trifluoromethyl)benzene.
What is the molecular weight of 3-Bromo-5-(trifluoromethyl)anisole?
The molecular weight is 255.03 g/mol.
What is the CAS number of 3-Bromo-5-(trifluoromethyl)anisole?
The CAS number is 627527-23-5.
What is the InChI of 3-Bromo-5-(trifluoromethyl)anisole?
The InChI is InChI=1S/C8H6BrF3O/c1-13-7-3-5(8(10,11)12)2-6(9)4-7/h2-4H,1H3.
What is the InChIKey of 3-Bromo-5-(trifluoromethyl)anisole?
The InChIKey is IBEKZIYJONXDRY-UHFFFAOYSA-N.
What is the canonical SMILES of 3-Bromo-5-(trifluoromethyl)anisole?
The canonical SMILES is COC1=CC(=CC(=C1)C(F)(F)F)Br.
What is the XLogP3-AA value of 3-Bromo-5-(trifluoromethyl)anisole?
The XLogP3-AA value is 3.5.
How many hydrogen bond donor counts does 3-Bromo-5-(trifluoromethyl)anisole have?
It has 0 hydrogen bond donor count.
How many hydrogen bond acceptor counts does 3-Bromo-5-(trifluoromethyl)anisole have?
It has 4 hydrogen bond acceptor count.
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