CAS
90771-97-4 Purity
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90771-97-4 Purity
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2-Bromo-1-ethynyl-4,5-dimethoxy-benzene
CAS
90772-55-7
Catalog Number
ACM90772557
Category
Other Products
Molecular Weight
241.08126
Molecular Formula
C10H9BrO2
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Specification
Synonyms
2-BROMO-1-ETHYNYL-4,5-DIMETHOXY-BENZENE
What is the molecular formula of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The molecular formula of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is C10H9BrO2.
When was 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene created and modified in PubChem?
2-Bromo-1-ethynyl-4,5-dimethoxy-benzene was created on February 8, 2007, and modified on December 30, 2023.
What is the IUPAC name of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The IUPAC name of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is 1-bromo-2-ethynyl-4,5-dimethoxybenzene.
What is the InChI of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The InChI of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is InChI=1S/C10H9BrO2/c1-4-7-5-9(12-2)10(13-3)6-8(7)11/h1,5-6H,2-3H3.
What is the Canonical SMILES of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The Canonical SMILES of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is COC1=C(C=C(C(=C1)C#C)Br)OC.
What is the molecular weight of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The molecular weight of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is 241.08 g/mol.
How many hydrogen bond acceptor counts does 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene have?
2-Bromo-1-ethynyl-4,5-dimethoxy-benzene has 2 hydrogen bond acceptor counts.
What is the topological polar surface area of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene?
The topological polar surface area of 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is 18.5 Ų.
How many rotatable bond counts does 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene have?
2-Bromo-1-ethynyl-4,5-dimethoxy-benzene has 3 rotatable bond counts.
Is 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene a canonicalized compound according to PubChem?
Yes, 2-Bromo-1-ethynyl-4,5-dimethoxy-benzene is a canonicalized compound in PubChem.
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