CAS
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3-[(3-Bromobenzyl)oxy]benzaldehyde
Catalog Number
ACMA00002470
Category
Ethers
Molecular Weight
291.14
Molecular Formula
C14H10Cl2O2
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Specification
Hazard Statements
H302-H318
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS05
What is the molecular formula of the compound in PubChem CID 3596769?
The molecular formula of the compound is C14H11BrO2.
What is the molecular weight of the compound?
The molecular weight of the compound is 291.14 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 3-[(3-bromophenyl)methoxy]benzaldehyde.
What is the InChIKey of the compound?
The InChIKey of the compound is VLPAVSIRLRIOPD-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are there in the compound?
There are 2 hydrogen bond acceptor counts in the compound.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 26.3Ų.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 3.5.
How many rotatable bond counts are there in the compound?
There are 4 rotatable bond counts in the compound.
What is the complexity value of the compound?
The complexity value of the compound is 244.
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