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9-Chloro-2,3-dihydro-[1,4]dioxino[2,3-c]chromen-5-one

HCID 349740
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Basic information

CAS
7003-18-1
Standard SMILES
O=c1oc2ccc(Cl)cc2c2c1OCCO2
InChIKey
PHJYKTYGTLKALD-UHFFFAOYSA-N
Molecular formula
C11H7ClO4
Average molar mass
238.62 g/mol
Monoisotopic mass
238.0032864

Names & identifiers

Preferred name
9-Chloro-2,3-dihydro-[1,4]dioxino[2,3-c]chromen-5-one
IUPAC
9-chloro-2,3-dihydro-[1,4]dioxino[2,3-c]chromen-5-one

Names & synonyms

9-chloro-2,3-dihydro-[1,4]dioxino[2,3-c]chromen-5-one7003-18-1NSC409584DTXSID70325297NSC-4095849-Chloro-2,3-dihydro-5H-[1,4]dioxino[2,3-c][1]benzopyran-5-one

Database identifiers

CAS
7003-18-1
PubChem CID
349740
DTXSID
DTXSID70325297

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
16
Formal charge
0
Complexity
352

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