spiro[benzo[c]chromene-6,2'-pyran]

C17H12O2 — CID 134973282

IUPACspiro[benzo[c]chromene-6,2'-pyran]
SMILESC1=COC2(C=C1)Oc1ccccc1-c1ccccc12
InChIInChI=1S/C17H12O2/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)19-17(15)11-5-6-12-18-17/h1-12H
InChIKeyVASUTQZCXBHEOZ-UHFFFAOYSA-N
MW248.28 g/mol
LogP4.00
Rot. Bonds

About spiro[benzo[c]chromene-6,2'-pyran]

spiro[benzo[c]chromene-6,2'-pyran] (PubChem CID 134973282) has the molecular formula C17H12O2 and a molecular weight of 248.28 g/mol. Its IUPAC name is spiro[benzo[c]chromene-6,2'-pyran].

Molecular Properties

Compound Namespiro[benzo[c]chromene-6,2'-pyran]
PubChem CID134973282
Molecular FormulaC17H12O2
Molecular Weight248.28 g/mol
Exact Mass248.08
IUPAC Namespiro[benzo[c]chromene-6,2'-pyran]
SMILESC1=COC2(C=C1)Oc1ccccc1-c1ccccc12
InChIInChI=1S/C17H12O2/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)19-17(15)11-5-6-12-18-17/h1-12H
InChIKeyVASUTQZCXBHEOZ-UHFFFAOYSA-N
XLogP4.00
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of spiro[benzo[c]chromene-6,2'-pyran]?
The IUPAC name of spiro[benzo[c]chromene-6,2'-pyran] (CID 134973282) is spiro[benzo[c]chromene-6,2'-pyran].
What is the SMILES notation for spiro[benzo[c]chromene-6,2'-pyran]?
The canonical SMILES for spiro[benzo[c]chromene-6,2'-pyran] is C1=COC2(C=C1)Oc1ccccc1-c1ccccc12.
What is the InChIKey of spiro[benzo[c]chromene-6,2'-pyran]?
The InChIKey is VASUTQZCXBHEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12O2/c1-3-9-15-13(7-1)14-8-2-4-10-16(14)19-17(15)11-5-6-12-18-17/h1-12H.
What are the key properties of spiro[benzo[c]chromene-6,2'-pyran]?
spiro[benzo[c]chromene-6,2'-pyran] has a molecular weight of 248.28 g/mol, XLogP of 4.00, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[benzo[c]chromene-6,2'-pyran] is sourced from PubChem (CID 134973282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).