furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol

C17H13O4P — CID 14686894

IUPACfuran-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol
SMILESO=P1(C(O)c2ccco2)Oc2ccccc2-c2ccccc21
InChIInChI=1S/C17H13O4P/c18-17(15-9-5-11-20-15)22(19)16-10-4-2-7-13(16)12-6-1-3-8-14(12)21-22/h1-11,17-18H
InChIKeyJJFBKVQKIGUWEN-UHFFFAOYSA-N
MW312.26 g/mol
LogP3.93
Rot. Bonds2

About furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol

furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol (PubChem CID 14686894) has the molecular formula C17H13O4P and a molecular weight of 312.26 g/mol. Its IUPAC name is furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol.

Molecular Properties

Compound Namefuran-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol
PubChem CID14686894
Molecular FormulaC17H13O4P
Molecular Weight312.26 g/mol
Exact Mass312.06
IUPAC Namefuran-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol
SMILESO=P1(C(O)c2ccco2)Oc2ccccc2-c2ccccc21
InChIInChI=1S/C17H13O4P/c18-17(15-9-5-11-20-15)22(19)16-10-4-2-7-13(16)12-6-1-3-8-14(12)21-22/h1-11,17-18H
InChIKeyJJFBKVQKIGUWEN-UHFFFAOYSA-N
XLogP3.93
TPSA59.67 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.26
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-[hydroxy-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]naphthalen-2-yl]-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol
CID 126498091
2,2-dimethyl-1-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)propan-1-ol
CID 14686892
6-butan-2-ylbenzo[c][2,1]benzoxaphosphinine 6-oxide
CID 71018079
3-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)propane-1,2-diol
CID 20662894
N-butyl-N-[2-methyl-1-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)propyl]hydroxylamine
CID 146515346
6-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)sulfonylbenzo[c][2,1]benzoxaphosphinine 6-oxide
CID 155351564
6-[(4-ethenylphenyl)methoxy-[4-[(4-ethenylphenyl)methoxy-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]phenyl]methyl]benzo[c][2,1]benzoxaphosphinine 6-oxide
CID 126498108
CID 157451486
CID 157451486
1-[4-[(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]phenyl]butan-2-ol
CID 23594103
6-[[4-(oxiran-2-ylmethoxy)phenyl]-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]benzo[c][2,1]benzoxaphosphinine 6-oxide
CID 129290034
6-prop-2-ynylbenzo[c][2,1]benzoxaphosphinine 6-oxide
CID 174185485
N,N-bis[2-[bis[(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]amino]ethyl]-N',N'-bis[(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methyl]ethane-1,2-diamine
CID 164746026

Frequently Asked Questions

What is the IUPAC name of furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol?
The IUPAC name of furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol (CID 14686894) is furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol.
What is the SMILES notation for furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol?
The canonical SMILES for furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol is O=P1(C(O)c2ccco2)Oc2ccccc2-c2ccccc21.
What is the InChIKey of furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol?
The InChIKey is JJFBKVQKIGUWEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13O4P/c18-17(15-9-5-11-20-15)22(19)16-10-4-2-7-13(16)12-6-1-3-8-14(12)21-22/h1-11,17-18H.
What are the key properties of furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol?
furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol has a molecular weight of 312.26 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-yl-(6-oxobenzo[c][2,1]benzoxaphosphinin-6-yl)methanol is sourced from PubChem (CID 14686894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).