CAS
943418-43-7 Purity
95%
943418-43-7 Purity
95%
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1-[4-[(6-Bromohexyl)oxy]butyl]benzene
CAS
94749-73-2
Catalog Number
ACM94749732
Category
Main Products
Molecular Weight
313.27
Molecular Formula
C16H25BrO
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Specification
Appearance
Solid
What is the molecular formula of the compound with the keyword?
The molecular formula is C16H25BrO.
What is the molecular weight of the compound with the keyword?
The molecular weight is 313.27 g/mol.
What is the IUPAC name of the compound with the keyword?
The IUPAC name is 4-(6-bromohexoxy)butylbenzene.
What is the InChI of the compound with the keyword?
The InChI is InChI=1S/C16H25BrO/c17-13-7-1-2-8-14-18-15-9-6-12-16-10-4-3-5-11-16/h3-5,10-11H,1-2,6-9,12-15H2.
What is the InChIKey of the compound with the keyword?
The InChIKey is HYRIAERKUPZOCS-UHFFFAOYSA-N.
What is the canonical SMILES of the compound with the keyword?
The canonical SMILES is C1=CC=C(C=C1)CCCCOCCCCCCBr.
What is the CAS number of the compound with the keyword?
The CAS number is 94749-73-2.
How many hydrogen bond donor counts does the compound with the keyword have?
The compound does not have any hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound with the keyword have?
The compound has 1 hydrogen bond acceptor count.
How many rotatable bond counts does the compound with the keyword have?
The compound has 11 rotatable bond counts.
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