CAS
898791-07-6 Purity
96%
898791-07-6 Purity
96%
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5-(2,3-Dichlorophenyl)-5-oxovaleric acid
CAS
898791-10-1
Catalog Number
ACM898791101
Category
Other Products
Molecular Weight
261.1
Molecular Formula
C11H10Cl2O3
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Specification
Synonyms
5-(2,3-DICHLOROPHENYL)-5-OXOVALERIC ACID
IUPAC Name
5-(2,3-dichlorophenyl)-5-oxopentanoic acid
InChI Key
XCHMPAYESAHTMQ-UHFFFAOYSA-N
Boiling Point
428.9ºC at 760 mmHg
Flash Point
213.2ºC
Density
1.381g/cm³
Exact Mass
260.00100
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of the compound with PubChem CID 24727027?
The molecular formula is C11H10Cl2O3.
What is the molecular weight of the compound?
The molecular weight is 261.10 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 5-(2,3-dichlorophenyl)-5-oxopentanoic acid.
What is the InChI key of the compound?
The InChI key is XCHMPAYESAHTMQ-UHFFFAOYSA-N.
How many hydrogen bond donor count does the compound have?
The compound has 1 hydrogen bond donor.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.7.
How many rotatable bond count does the compound have?
The compound has 5 rotatable bonds.
What is the exact mass of the compound?
The exact mass is 260.0006996 g/mol.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
What is the topological polar surface area of the compound?
The topological polar surface area is 54.4 Å2.
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