3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one

C15H12O5 — CID 169439551

IUPAC3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one
SMILESCOc1cc(OC)c2c(c1)c(=O)oc1cc(O)ccc12
InChIInChI=1S/C15H12O5/c1-18-9-6-11-14(13(7-9)19-2)10-4-3-8(16)5-12(10)20-15(11)17/h3-7,16H,1-2H3
InChIKeyZMZUANGKUDGEET-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.67
Rot. Bonds2

About 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one

3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one (PubChem CID 169439551) has the molecular formula C15H12O5 and a molecular weight of 272.26 g/mol. Its IUPAC name is 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one.

Molecular Properties

Compound Name3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one
PubChem CID169439551
Molecular FormulaC15H12O5
Molecular Weight272.26 g/mol
Exact Mass272.07
IUPAC Name3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one
SMILESCOc1cc(OC)c2c(c1)c(=O)oc1cc(O)ccc12
InChIInChI=1S/C15H12O5/c1-18-9-6-11-14(13(7-9)19-2)10-4-3-8(16)5-12(10)20-15(11)17/h3-7,16H,1-2H3
InChIKeyZMZUANGKUDGEET-UHFFFAOYSA-N
XLogP2.67
TPSA68.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

9-hydroxy-3-methoxy-[1]benzofuro[3,2-c]chromen-6-one
CID 131750884
3-(2,5-dimethoxyphenyl)-7-hydroxy-4-methylchromen-2-one
CID 6217099
1-chloro-3-hydroxy-9-methoxybenzo[c]chromen-6-one
CID 171936004
2-(4-hydroxyphenyl)-3,5,7-trimethoxychromen-4-one
CID 14414499
3-hydroxy-9-methoxy-1-propan-2-ylbenzo[c]chromen-6-one
CID 171936010
7,9-dimethoxy-2,3-bis(phenylmethoxy)benzo[c]chromen-6-one
CID 102527760
N-[(2,4-dimethoxyphenyl)methyl]-2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)acetamide
CID 6236159
7-hydroxy-3-[(4-methoxyphenyl)diazenyl]-4-methylchromen-2-one
CID 135456776
8-amino-10-methoxybenzo[c]chromen-6-one
CID 18732397
(7-hydroxy-4-methoxy-2-oxochromen-3-yl) acetate
CID 19929885
7-hydroxy-2-[(4-methoxyphenyl)methyl]chromen-4-one
CID 10708015
9-(3,8-dihydroxy-6-oxobenzo[c]chromen-9-yl)-3,8-dihydroxybenzo[c]chromen-6-one
CID 11510769

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one?
The IUPAC name of 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one (CID 169439551) is 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one.
What is the SMILES notation for 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one?
The canonical SMILES for 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one is COc1cc(OC)c2c(c1)c(=O)oc1cc(O)ccc12.
What is the InChIKey of 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one?
The InChIKey is ZMZUANGKUDGEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O5/c1-18-9-6-11-14(13(7-9)19-2)10-4-3-8(16)5-12(10)20-15(11)17/h3-7,16H,1-2H3.
What are the key properties of 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one?
3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one has a molecular weight of 272.26 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-8,10-dimethoxybenzo[c]chromen-6-one is sourced from PubChem (CID 169439551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).