CAS
886500-26-1 Purity
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886500-26-1 Purity
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4-Bromo-2,5-dimethylbenzotrifluoride
CAS
887268-18-0
Catalog Number
ACM887268180
Category
Bromine Series
Molecular Weight
253.06
Molecular Formula
C9H8BrF3
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Specification
Synonyms
2,5-DIMETHYL-4-TRIFLUOROMETHYL-BROMOBENZENE;1-BROMO-2,5-DIMETHYL-4-TRIFLUOROMETHYL-BENZENE;4-BROMO-2,5-DIMETHYLBENZOTRIFLUORIDE
What is the molecular formula of 4-Bromo-2,5-dimethylbenzotrifluoride?
The molecular formula of 4-Bromo-2,5-dimethylbenzotrifluoride is C9H8BrF3.
What is the molecular weight of 4-Bromo-2,5-dimethylbenzotrifluoride?
The molecular weight of 4-Bromo-2,5-dimethylbenzotrifluoride is 253.06 g/mol.
What is the IUPAC name of 4-Bromo-2,5-dimethylbenzotrifluoride?
The IUPAC name of 4-Bromo-2,5-dimethylbenzotrifluoride is 1-bromo-2,5-dimethyl-4-(trifluoromethyl)benzene.
What is the InChI of 4-Bromo-2,5-dimethylbenzotrifluoride?
The InChI of 4-Bromo-2,5-dimethylbenzotrifluoride is InChI=1S/C9H8BrF3/c1-5-4-8(10)6(2)3-7(5)9(11,12)13/h3-4H,1-2H3.
What is the InChIKey of 4-Bromo-2,5-dimethylbenzotrifluoride?
The InChIKey of 4-Bromo-2,5-dimethylbenzotrifluoride is JQFCVKLDNIXKPP-UHFFFAOYSA-N.
What is the canonical SMILES of 4-Bromo-2,5-dimethylbenzotrifluoride?
The canonical SMILES of 4-Bromo-2,5-dimethylbenzotrifluoride is CC1=CC(=C(C=C1Br)C)C(F)(F)F.
What is the XLogP3-AA value of 4-Bromo-2,5-dimethylbenzotrifluoride?
The XLogP3-AA value of 4-Bromo-2,5-dimethylbenzotrifluoride is 4.2.
How many hydrogen bond donor counts does 4-Bromo-2,5-dimethylbenzotrifluoride have?
4-Bromo-2,5-dimethylbenzotrifluoride has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does 4-Bromo-2,5-dimethylbenzotrifluoride have?
4-Bromo-2,5-dimethylbenzotrifluoride has 3 hydrogen bond acceptor counts.
How many rotatable bond counts does 4-Bromo-2,5-dimethylbenzotrifluoride have?
4-Bromo-2,5-dimethylbenzotrifluoride has 0 rotatable bond counts.
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