benzo[c][1,6]benzodioxocine

C14H10O2 — CID 170684169

IUPACbenzo[c][1,6]benzodioxocine
SMILESc1ccc2coc3ccccc3occ2c1
InChIInChI=1S/C14H10O2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-
InChIKeyISFMFVNYUIWWBI-HWAYABPNSA-N
MW210.23 g/mol
LogP4.30
Rot. Bonds

About benzo[c][1,6]benzodioxocine

benzo[c][1,6]benzodioxocine (PubChem CID 170684169) has the molecular formula C14H10O2 and a molecular weight of 210.23 g/mol. Its IUPAC name is benzo[c][1,6]benzodioxocine.

Molecular Properties

Compound Namebenzo[c][1,6]benzodioxocine
PubChem CID170684169
Molecular FormulaC14H10O2
Molecular Weight210.23 g/mol
Exact Mass210.07
IUPAC Namebenzo[c][1,6]benzodioxocine
SMILESc1ccc2coc3ccccc3occ2c1
InChIInChI=1S/C14H10O2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-
InChIKeyISFMFVNYUIWWBI-HWAYABPNSA-N
XLogP4.30
TPSA26.28 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of benzo[c][1,6]benzodioxocine?
The IUPAC name of benzo[c][1,6]benzodioxocine (CID 170684169) is benzo[c][1,6]benzodioxocine.
What is the SMILES notation for benzo[c][1,6]benzodioxocine?
The canonical SMILES for benzo[c][1,6]benzodioxocine is c1ccc2coc3ccccc3occ2c1.
What is the InChIKey of benzo[c][1,6]benzodioxocine?
The InChIKey is ISFMFVNYUIWWBI-HWAYABPNSA-N. The full InChI is InChI=1S/C14H10O2/c1-2-6-12-10-16-14-8-4-3-7-13(14)15-9-11(12)5-1/h1-10H/b11-9-,12-10-.
What are the key properties of benzo[c][1,6]benzodioxocine?
benzo[c][1,6]benzodioxocine has a molecular weight of 210.23 g/mol, XLogP of 4.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzo[c][1,6]benzodioxocine is sourced from PubChem (CID 170684169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).