CAS
979-77-8 Purity
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979-77-8 Purity
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3-(tert-Butyl)phenyl carbonochloridothioate
CAS
97986-06-6
Catalog Number
ACM97986066
Category
Other Products
Molecular Weight
228.74
Molecular Formula
C11H13ClOS
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What is the molecular formula of the compound?
The molecular formula of the compound is C11H13ClOS.
What is the molecular weight of the compound?
The molecular weight of the compound is 228.74 g/mol.
What is the CAS number of the compound?
The CAS number of the compound is 97986-06-6.
What is the IUPAC name of the compound?
The IUPAC name of the compound is O-(3-tert-butylphenyl) chloromethanethioate.
What is the InChI key of the compound?
The InChI key of the compound is RVFDGINAGFKENO-UHFFFAOYSA-N.
What is the XLogP3 value of the compound?
The XLogP3 value of the compound is 4.8.
How many hydrogen bond donor counts does the compound have?
The compound has 0 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 2 hydrogen bond acceptor counts.
How many rotatable bond counts does the compound have?
The compound has 3 rotatable bond counts.
Is the compound canonicalized?
Yes, the compound is canonicalized.
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