6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol

C13H14O2 — CID 69332677

IUPAC6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol
SMILESOC1=CC=CC2OCC3C=CC=CC3C12
InChIInChI=1S/C13H14O2/c14-11-6-3-7-12-13(11)10-5-2-1-4-9(10)8-15-12/h1-7,9-10,12-14H,8H2
InChIKeyCSKYHRUFKUQRSD-UHFFFAOYSA-N
MW202.25 g/mol
LogP2.37
Rot. Bonds

About 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol

6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol (PubChem CID 69332677) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol.

Molecular Properties

Compound Name6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol
PubChem CID69332677
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol
SMILESOC1=CC=CC2OCC3C=CC=CC3C12
InChIInChI=1S/C13H14O2/c14-11-6-3-7-12-13(11)10-5-2-1-4-9(10)8-15-12/h1-7,9-10,12-14H,8H2
InChIKeyCSKYHRUFKUQRSD-UHFFFAOYSA-N
XLogP2.37
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol?
The IUPAC name of 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol (CID 69332677) is 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol.
What is the SMILES notation for 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol?
The canonical SMILES for 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol is OC1=CC=CC2OCC3C=CC=CC3C12.
What is the InChIKey of 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol?
The InChIKey is CSKYHRUFKUQRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O2/c14-11-6-3-7-12-13(11)10-5-2-1-4-9(10)8-15-12/h1-7,9-10,12-14H,8H2.
What are the key properties of 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol?
6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol has a molecular weight of 202.25 g/mol, XLogP of 2.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6a,10a,10b-tetrahydro-4aH-benzo[c]chromen-1-ol is sourced from PubChem (CID 69332677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).