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6-Chlorochroman-3-one

Catalog Number ACM26371482-1
CAS 26371-48-2
Structure {[CurrentData.Name]}
IUPAC Name 6-chloro-4H-chromen-3-one
Synonyms 6-Chlorochroman-3-one;26371-48-2;6-Chloro-3-Chromanone;6-chloro-4H-chromen-3-one;6-chloro-3,4-dihydro-2H-1-benzopyran-3-one;PubChem18387;2H-1-Benzopyran-3(4H)-one, 6-chloro-;SCHEMBL429962;6-chloranyl-4H-chromen-3-one;DTXSID80618440;ANW-66789;MFCD10696152;ZINC49588537;AKOS006303377;AB56616;DS-2583;FS-3708;MP-1318;6-Chloro-2H-1-benzopyran-3(4H)-one;AK-96205;DA-36965;AB0056849;FT-0659400;Z4519;A818408
Molecular Weight 182.60g/mol
Molecular Formula C9H7ClO2
Canonical SMILES C1C(=O)COC2=C1C=C(C=C2)Cl
InChI InChI=1S/C9H7ClO2/c10-7-1-2-9-6(3-7)4-8(11)5-12-9/h1-3H,4-5H2
InChI Key XRBIZKTYVWJBDA-UHFFFAOYSA-N
Complexity 193
Covalently-Bonded Unit Count 1
Exact Mass 182.0134572g/mol
Heavy Atom Count 12
Hydrogen Bond Acceptor Count 2
Monoisotopic Mass 182.0134572g/mol
Rotatable Bond Count 0
Topological Polar Surface Area 26.3Ų
X Log P3 2
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