9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine

C20H20N2O4 — CID 87812173

IUPAC9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine
SMILESCOc1c2occc2cc2ccc(=O)oc12.NNCCc1ccccc1
InChIInChI=1S/C12H8O4.C8H12N2/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12;9-10-7-6-8-4-2-1-3-5-8/h2-6H,1H3;1-5,10H,6-7,9H2
InChIKeyVKFZLLRZCPVHNV-UHFFFAOYSA-N
MW352.39 g/mol
LogP3.24
Rot. Bonds4

About 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine

9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine (PubChem CID 87812173) has the molecular formula C20H20N2O4 and a molecular weight of 352.39 g/mol. Its IUPAC name is 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine.

Molecular Properties

Compound Name9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine
PubChem CID87812173
Molecular FormulaC20H20N2O4
Molecular Weight352.39 g/mol
Exact Mass352.14
IUPAC Name9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine
SMILESCOc1c2occc2cc2ccc(=O)oc12.NNCCc1ccccc1
InChIInChI=1S/C12H8O4.C8H12N2/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12;9-10-7-6-8-4-2-1-3-5-8/h2-6H,1H3;1-5,10H,6-7,9H2
InChIKeyVKFZLLRZCPVHNV-UHFFFAOYSA-N
XLogP3.24
TPSA90.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4,9-dimethoxy-7-methylfuro[3,2-g]chromen-5-one;9-methoxyfuro[3,2-g]chromen-7-one;4-methoxy-7-methylfuro[3,2-g]chromen-5-one
CID 90014454
9-(3-methylbut-3-enoxy)furo[3,2-g]chromen-7-one
CID 88593145
9-prop-2-enoxyfuro[3,2-g]chromen-7-one
CID 12772891
6,9-dimethoxyfuro[3,2-g]chromen-7-one
CID 162954725
9-[[(2S)-2,3,3-trimethyloxiran-2-yl]methoxy]furo[3,2-g]chromen-7-one
CID 163032270
9-[(2S)-3,3-dimethyloxiran-2-yl]oxyfuro[3,2-g]chromen-7-one
CID 162888730
9-(2-methylbut-3-en-2-yloxy)furo[3,2-g]chromen-7-one
CID 71331273
9-[(2R)-3-chloro-2-hydroxy-3-methylbutoxy]furo[3,2-g]chromen-7-one
CID 91885198
9-[3-[4-(4-phenylbut-3-enylamino)pyridin-1-ium-1-yl]propoxy]furo[3,2-g]chromen-7-one
CID 91574832
9-(hydroxymethyl)furo[3,2-g]chromen-7-one
CID 20823678
9-[3-(2-methoxyethoxymethoxy)propyl]furo[3,2-g]chromen-7-one
CID 142673674
9-[(2,5,5-trimethylcyclohexen-1-yl)methoxy]furo[3,2-g]chromen-7-one
CID 657158

Frequently Asked Questions

What is the IUPAC name of 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine?
The IUPAC name of 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine (CID 87812173) is 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine.
What is the SMILES notation for 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine?
The canonical SMILES for 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine is COc1c2occc2cc2ccc(=O)oc12.NNCCc1ccccc1.
What is the InChIKey of 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine?
The InChIKey is VKFZLLRZCPVHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O4.C8H12N2/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12;9-10-7-6-8-4-2-1-3-5-8/h2-6H,1H3;1-5,10H,6-7,9H2.
What are the key properties of 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine?
9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine has a molecular weight of 352.39 g/mol, XLogP of 3.24, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxyfuro[3,2-g]chromen-7-one;2-phenylethylhydrazine is sourced from PubChem (CID 87812173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).