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3- (2,4- Dichlorophenyl) -7-hydroxycoumarin

CAT: 0127-OR345572Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
263364-98-3
MDL Number
MFCD02093191
Purity
=95%
Smiles
Oc1ccc2C=C(C(=O)Oc2c1)c3ccc(Cl)cc3Cl

Chemical Information

3-(2,4-Dichlorophenyl)-7-hydroxychromen-2-one
CAS Number263364-98-3
PubChem CID5393171
IUPAC Name3-(2,4-dichlorophenyl)-7-hydroxychromen-2-one
Molecular FormulaC15H8Cl2O3
Molecular Weight307.1
XLogP4.4
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count20
Formal Charge0
Complexity423
SMILES
C1=CC2=C(C=C1O)OC(=O)C(=C2)C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C15H8Cl2O3/c16-9-2-4-11(13(17)6-9)12-5-8-1-3-10(18)7-14(8)20-15(12)19/h1-7,18H
InChIKey
BWLCJPSUKHSVKP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(2,4-Dichlorophenyl)-7-hydroxychromen-2-one
CAS: 263364-98-3
CID: 5393171
Formula: C15H8Cl2O3
MW: 307.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight307.1
XLogP34.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass305.9850495
Monoisotopic Mass305.9850495
Topological Polar Surface Area46.5 Ų
Heavy Atom Count20
Formal Charge0
Complexity423
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
sc-3373067-chloro-2- (2,4-dichlorophenyl) -8-methylquinoline-4-carbonyl chloride
sc-3196467-Chloro-2- (2,4-dichlorophenyl) -8-methylquinoline-4-carboxylic acid
SCA16556-014- (3,4-Dichlorophenyl) -7-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinoline
sc-3373177-chloro-2- (3,4-dichlorophenyl) -8-methylquinoline-4-carbonyl chloride
sc-3196597-Chloro-2- (3,4-dichlorophenyl) -8-methylquinoline-4-carboxylic acid
XQB731863- (2,4-dichlorophenyl) -7-methyl-1,4,6,7,8-pentahydrocinnolin-5-one
sc-3373087-chloro-2- (2,5-dichlorophenyl) -8-methylquinoline-4-carbonyl chloride
sc-3196487-Chloro-2- (2,5-dichlorophenyl) -8-methylquinoline-4-carboxylic acid
VZB82313-017- (2,4-Dichlorophenyl) pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
TRC-D040450-1G7-[4-[4-(2,4-Dichlorophenyl)-1-piperazinyl]butoxy]-3,4-dihydro-2(1H)-quinolinone

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