CAS
95382-33-5 Purity
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95382-33-5 Purity
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Benzoyl chloride, 3-cyano-4-methoxy- (9CI)
CAS
95383-40-7
Catalog Number
ACM95383407
Category
Other Products
Molecular Weight
195.60244
Molecular Formula
C9H6ClNO2
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Specification
Synonyms
Benzoyl chloride, 3-cyano-4-methoxy- (9CI)
What is the molecular formula of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The molecular formula is C9H6ClNO2.
When was Benzoyl chloride, 3-cyano-4-methoxy- (9CI) created and modified?
It was created on 2007-12-05 and modified on 2023-12-30.
What is the IUPAC name of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The IUPAC name is 3-cyano-4-methoxybenzoyl chloride.
What is the InChI of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The InChI is InChI=1S/C9H6ClNO2/c1-13-8-3-2-6(9(10)12)4-7(8)5-11/h2-4H,1H3.
What is the Canonical SMILES of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The Canonical SMILES is COC1=C(C=C(C=C1)C(=O)Cl)C#N.
What is the molecular weight of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The molecular weight is 195.60 g/mol.
How many hydrogen bond acceptors does Benzoyl chloride, 3-cyano-4-methoxy- (9CI) have?
It has 3 hydrogen bond acceptors.
What is the topological polar surface area of Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
The topological polar surface area is 50.1 Å2.
Does Benzoyl chloride, 3-cyano-4-methoxy- (9CI) have any defined atom stereocenters?
No, it does not have any defined atom stereocenters.
Is the compound canonicalized for Benzoyl chloride, 3-cyano-4-methoxy- (9CI)?
Yes, the compound is canonicalized.
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