CAS
914224-34-3 Purity
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914224-34-3 Purity
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Methyl 5-iodo-2-methoxy-4-methylbenzoate
CAS
914225-32-4
Catalog Number
ACM914225324
Category
Other Products
Molecular Weight
306.09701
Molecular Formula
C10H11IO3
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Specification
Synonyms
METHYL 5-IODO-2-METHOXY-4-METHYLBENZOATE
What is the IUPAC name of the compound?
The IUPAC name of the compound is methyl 5-iodo-2-methoxy-4-methylbenzoate.
What is the molecular formula of the compound?
The molecular formula of the compound is C10H11IO3.
What is the molecular weight of the compound?
The molecular weight of the compound is 306.10 g/mol.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CC1=CC(=C(C=C1I)C(=O)OC)OC.
How many hydrogen bond donor counts are present in the compound?
There are 0 hydrogen bond donor counts present in the compound.
How many hydrogen bond acceptor counts are present in the compound?
There are 3 hydrogen bond acceptor counts present in the compound.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 35.5 Ų.
How many rotatable bond counts are present in the compound?
There are 3 rotatable bond counts present in the compound.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the InChIKey of the compound?
The InChIKey of the compound is NPCVNRLZZVVKNV-UHFFFAOYSA-N.
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CAS
914224-76-3 Purity
96%
914224-76-3 Purity
96%
