CAS
898791-81-6 Purity
96%
898791-81-6 Purity
96%
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Cyclopentyl 2,5-dichlorophenyl ketone
CAS
898791-84-9
Catalog Number
ACM898791849
Category
Other Products
Molecular Weight
243.13
Molecular Formula
C12H12Cl2O
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Specification
Synonyms
CYCLOPENTYL 2,5-DICHLOROPHENYL KETONE
IUPAC Name
cyclopentyl-(2,5-dichlorophenyl)methanone
Canonical SMILES
C1CCC(C1)C(=O)C2=C(C=CC(=C2)Cl)Cl
InChI Key
ANOKAZMIUAFKFI-UHFFFAOYSA-N
Boiling Point
325.1ºC at 760 mmHg
Flash Point
136.9ºC
Density
1.282g/cm³
Exact Mass
242.02700
H-Bond Acceptor
1
H-Bond Donor
0
What is the molecular formula of Cyclopentyl 2,5-dichlorophenyl ketone?
The molecular formula of Cyclopentyl 2,5-dichlorophenyl ketone is C12H12Cl2O.
When was Cyclopentyl 2,5-dichlorophenyl ketone created in PubChem?
Cyclopentyl 2,5-dichlorophenyl ketone was created in PubChem on February 29, 2008.
What is the molecular weight of Cyclopentyl 2,5-dichlorophenyl ketone?
The molecular weight of Cyclopentyl 2,5-dichlorophenyl ketone is 243.13 g/mol.
What is the IUPAC name of Cyclopentyl 2,5-dichlorophenyl ketone?
The IUPAC name of Cyclopentyl 2,5-dichlorophenyl ketone is cyclopentyl-(2,5-dichlorophenyl)methanone.
What is the Canonical SMILES representation of Cyclopentyl 2,5-dichlorophenyl ketone?
The Canonical SMILES representation of Cyclopentyl 2,5-dichlorophenyl ketone is C1CCC(C1)C(=O)C2=C(C=CC(=C2)Cl)Cl.
What is the InChIKey of Cyclopentyl 2,5-dichlorophenyl ketone?
The InChIKey of Cyclopentyl 2,5-dichlorophenyl ketone is ANOKAZMIUAFKFI-UHFFFAOYSA-N.
What is the XLogP3-AA value of Cyclopentyl 2,5-dichlorophenyl ketone?
The XLogP3-AA value of Cyclopentyl 2,5-dichlorophenyl ketone is 4.4.
How many hydrogen bond donor counts does Cyclopentyl 2,5-dichlorophenyl ketone have?
Cyclopentyl 2,5-dichlorophenyl ketone has 0 hydrogen bond donor counts.
What is the topological polar surface area of Cyclopentyl 2,5-dichlorophenyl ketone?
The topological polar surface area of Cyclopentyl 2,5-dichlorophenyl ketone is 17.1 Ų.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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