CAS
134615-37-5 Purity
99%
134615-37-5 Purity
99%
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1,1,1-trifluoro-3-methylbutan-2-one
CAS
382-03-6
Catalog Number
ACM382036
Category
Main Products
Molecular Weight
140.1
Molecular Formula
C5H7F3O
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Specification
Appearance
Liquid
What is the molecular formula of 1,1,1-trifluoro-3-methylbutan-2-one?
The molecular formula is C5H7F3O.
What is the molecular weight of 1,1,1-trifluoro-3-methylbutan-2-one?
The molecular weight is 140.10 g/mol.
What is the IUPAC name of 1,1,1-trifluoro-3-methylbutan-2-one?
The IUPAC name is 1,1,1-trifluoro-3-methylbutan-2-one.
What is the InChI of 1,1,1-trifluoro-3-methylbutan-2-one?
The InChI is InChI=1S/C5H7F3O/c1-3(2)4(9)5(6,7)8/h3H,1-2H3.
What is the InChIKey of 1,1,1-trifluoro-3-methylbutan-2-one?
The InChIKey is NLCCAFQWEKMQLM-UHFFFAOYSA-N.
What is the canonical SMILES of 1,1,1-trifluoro-3-methylbutan-2-one?
The canonical SMILES is CC(C)C(=O)C(F)(F)F.
What is the CAS number of 1,1,1-trifluoro-3-methylbutan-2-one?
The CAS number is 382-03-6.
How many hydrogen bond donor count does 1,1,1-trifluoro-3-methylbutan-2-one have?
It has 0 hydrogen bond donor count.
How many hydrogen bond acceptor count does 1,1,1-trifluoro-3-methylbutan-2-one have?
It has 4 hydrogen bond acceptor count.
How many rotatable bond count does 1,1,1-trifluoro-3-methylbutan-2-one have?
It has 1 rotatable bond count.
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