3-methoxyfuro[3,2-g]chromen-7-one

C12H8O4 — CID 12896811

IUPAC3-methoxyfuro[3,2-g]chromen-7-one
SMILESCOc1coc2cc3oc(=O)ccc3cc12
InChIInChI=1S/C12H8O4/c1-14-11-6-15-10-5-9-7(4-8(10)11)2-3-12(13)16-9/h2-6H,1H3
InChIKeyZRSSNKQAHFVTPW-UHFFFAOYSA-N
MW216.19 g/mol
LogP2.55
Rot. Bonds1

About 3-methoxyfuro[3,2-g]chromen-7-one

3-methoxyfuro[3,2-g]chromen-7-one (PubChem CID 12896811) has the molecular formula C12H8O4 and a molecular weight of 216.19 g/mol. Its IUPAC name is 3-methoxyfuro[3,2-g]chromen-7-one.

Molecular Properties

Compound Name3-methoxyfuro[3,2-g]chromen-7-one
PubChem CID12896811
Molecular FormulaC12H8O4
Molecular Weight216.19 g/mol
Exact Mass216.04
IUPAC Name3-methoxyfuro[3,2-g]chromen-7-one
SMILESCOc1coc2cc3oc(=O)ccc3cc12
InChIInChI=1S/C12H8O4/c1-14-11-6-15-10-5-9-7(4-8(10)11)2-3-12(13)16-9/h2-6H,1H3
InChIKeyZRSSNKQAHFVTPW-UHFFFAOYSA-N
XLogP2.55
TPSA52.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.19
LogP ≤ 52.55
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

6,7-dimethoxychromen-2-one
CID 159563577
sodium;6,7-dimethoxychromen-2-one;chloride
CID 174522152
7-methoxy-6-nitrochromen-2-one
CID 10656586
7-hydroxychromen-2-one;7-hydroxy-6-methoxychromen-2-one
CID 158863716
(7-methoxy-2-oxochromen-6-yl) hydrogen sulfate
CID 163085757
7-methoxy-6-[(E)-3-methoxy-3-methylbut-1-enyl]chromen-2-one
CID 14212556
2,5-dihydroxy-4-methoxybenzaldehyde;6-hydroxy-7-methoxychromen-2-one
CID 160954791
3-bromo-6,7-dimethoxychromen-4-one
CID 67762458
(6-methoxy-2-oxochromen-7-yl) 3-methylbutanoate
CID 155292895
2-propan-2-yl-3-[(Z)-2-(2,3,4-trimethoxyphenyl)ethenyl]furo[3,2-g]chromen-7-one
CID 102358407
6-(3-ethoxy-3-methylbut-1-enyl)-7-methoxychromen-2-one
CID 162950846
6-[(2R,3S)-3-(2-hydroxypropan-2-yl)oxiran-2-yl]-7-methoxychromen-2-one
CID 163036838

Frequently Asked Questions

What is the IUPAC name of 3-methoxyfuro[3,2-g]chromen-7-one?
The IUPAC name of 3-methoxyfuro[3,2-g]chromen-7-one (CID 12896811) is 3-methoxyfuro[3,2-g]chromen-7-one.
What is the SMILES notation for 3-methoxyfuro[3,2-g]chromen-7-one?
The canonical SMILES for 3-methoxyfuro[3,2-g]chromen-7-one is COc1coc2cc3oc(=O)ccc3cc12.
What is the InChIKey of 3-methoxyfuro[3,2-g]chromen-7-one?
The InChIKey is ZRSSNKQAHFVTPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O4/c1-14-11-6-15-10-5-9-7(4-8(10)11)2-3-12(13)16-9/h2-6H,1H3.
What are the key properties of 3-methoxyfuro[3,2-g]chromen-7-one?
3-methoxyfuro[3,2-g]chromen-7-one has a molecular weight of 216.19 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxyfuro[3,2-g]chromen-7-one is sourced from PubChem (CID 12896811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).