3,4-dihydro-2H-chromen-8-ylmethanol

C10H12O2 — CID 84651870

IUPAC3,4-dihydro-2H-chromen-8-ylmethanol
SMILESOCc1cccc2c1OCCC2
InChIInChI=1S/C10H12O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h1,3-4,11H,2,5-7H2
InChIKeyIZGCYMKFFNZFAB-UHFFFAOYSA-N
MW164.20 g/mol
LogP1.50
Rot. Bonds1

About 3,4-dihydro-2H-chromen-8-ylmethanol

3,4-dihydro-2H-chromen-8-ylmethanol (PubChem CID 84651870) has the molecular formula C10H12O2 and a molecular weight of 164.20 g/mol. Its IUPAC name is 3,4-dihydro-2H-chromen-8-ylmethanol.

Molecular Properties

Compound Name3,4-dihydro-2H-chromen-8-ylmethanol
PubChem CID84651870
Molecular FormulaC10H12O2
Molecular Weight164.20 g/mol
Exact Mass164.08
IUPAC Name3,4-dihydro-2H-chromen-8-ylmethanol
SMILESOCc1cccc2c1OCCC2
InChIInChI=1S/C10H12O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h1,3-4,11H,2,5-7H2
InChIKeyIZGCYMKFFNZFAB-UHFFFAOYSA-N
XLogP1.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-chromen-8-ylmethanol?
The IUPAC name of 3,4-dihydro-2H-chromen-8-ylmethanol (CID 84651870) is 3,4-dihydro-2H-chromen-8-ylmethanol.
What is the SMILES notation for 3,4-dihydro-2H-chromen-8-ylmethanol?
The canonical SMILES for 3,4-dihydro-2H-chromen-8-ylmethanol is OCc1cccc2c1OCCC2.
What is the InChIKey of 3,4-dihydro-2H-chromen-8-ylmethanol?
The InChIKey is IZGCYMKFFNZFAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O2/c11-7-9-4-1-3-8-5-2-6-12-10(8)9/h1,3-4,11H,2,5-7H2.
What are the key properties of 3,4-dihydro-2H-chromen-8-ylmethanol?
3,4-dihydro-2H-chromen-8-ylmethanol has a molecular weight of 164.20 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-chromen-8-ylmethanol is sourced from PubChem (CID 84651870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).