2-methoxy-[1]benzofuro[3,2-c]chromen-6-one

C16H10O4 — CID 110272886

IUPAC2-methoxy-[1]benzofuro[3,2-c]chromen-6-one
SMILESCOc1ccc2oc(=O)c3c4ccccc4oc3c2c1
InChIInChI=1S/C16H10O4/c1-18-9-6-7-13-11(8-9)15-14(16(17)20-13)10-4-2-3-5-12(10)19-15/h2-8H,1H3
InChIKeyHBUKKEKQOHWDAZ-UHFFFAOYSA-N
MW266.25 g/mol
LogP3.70
Rot. Bonds1

About 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one

2-methoxy-[1]benzofuro[3,2-c]chromen-6-one (PubChem CID 110272886) has the molecular formula C16H10O4 and a molecular weight of 266.25 g/mol. Its IUPAC name is 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one.

Molecular Properties

Compound Name2-methoxy-[1]benzofuro[3,2-c]chromen-6-one
PubChem CID110272886
Molecular FormulaC16H10O4
Molecular Weight266.25 g/mol
Exact Mass266.06
IUPAC Name2-methoxy-[1]benzofuro[3,2-c]chromen-6-one
SMILESCOc1ccc2oc(=O)c3c4ccccc4oc3c2c1
InChIInChI=1S/C16H10O4/c1-18-9-6-7-13-11(8-9)15-14(16(17)20-13)10-4-2-3-5-12(10)19-15/h2-8H,1H3
InChIKeyHBUKKEKQOHWDAZ-UHFFFAOYSA-N
XLogP3.70
TPSA52.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}

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Related Compounds

3-chloro-8-methoxy-2-phenylfuro[3,2-c]chromen-4-one
CID 102407236
2,3-dimethyl-[1]benzofuro[3,2-c]chromen-6-one
CID 102369758
9-hydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
CID 131750884
7-methoxy-4-oxahexacyclo[12.12.0.02,11.05,10.015,20.021,26]hexacosa-1(14),2(11),5(10),6,8,12,15,17,19,21,23,25-dodecaen-3-one
CID 118617499
9-methoxy-[1]benzothiolo[3,2-c]chromen-6-one
CID 54450197
8-bromo-[1]benzofuro[3,2-c]chromen-6-one
CID 132544838
ethane-1,2-diol;2-methoxyxanthen-9-one
CID 126598327
1,4-dihydroxy-7-methoxyxanthen-9-one
CID 15819467
5,16-dimethoxy-9,20-dioxaheptacyclo[13.11.1.12,10.03,8.019,27.021,26.014,28]octacosa-1,3(8),4,6,10,12,14(28),15,17,19(27),21,23,25-tridecaene
CID 53382046
8-methoxynaphtho[1,2-c]chromen-5-one
CID 118617567
1-hydroxy-8-methoxy-3-phenylbenzo[c]chromen-6-one
CID 57325894
7-methoxy-4-oxapentacyclo[12.8.0.02,11.05,10.015,20]docosa-1(14),2(11),5(10),6,8,12,15,17,19,21-decaen-3-one
CID 118617487

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one?
The IUPAC name of 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one (CID 110272886) is 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one.
What is the SMILES notation for 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one?
The canonical SMILES for 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one is COc1ccc2oc(=O)c3c4ccccc4oc3c2c1.
What is the InChIKey of 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one?
The InChIKey is HBUKKEKQOHWDAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10O4/c1-18-9-6-7-13-11(8-9)15-14(16(17)20-13)10-4-2-3-5-12(10)19-15/h2-8H,1H3.
What are the key properties of 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one?
2-methoxy-[1]benzofuro[3,2-c]chromen-6-one has a molecular weight of 266.25 g/mol, XLogP of 3.70, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-[1]benzofuro[3,2-c]chromen-6-one is sourced from PubChem (CID 110272886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).