(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol

C13H16O — CID 174415170

IUPAC(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol
SMILESCCC1=Cc2cc(CO)ccc2CC1
InChIInChI=1S/C13H16O/c1-2-10-3-5-12-6-4-11(9-14)8-13(12)7-10/h4,6-8,14H,2-3,5,9H2,1H3
InChIKeyRGSXBNWBDZSFON-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.92
Rot. Bonds2

About (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol

(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol (PubChem CID 174415170) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol.

Molecular Properties

Compound Name(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol
PubChem CID174415170
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol
SMILESCCC1=Cc2cc(CO)ccc2CC1
InChIInChI=1S/C13H16O/c1-2-10-3-5-12-6-4-11(9-14)8-13(12)7-10/h4,6-8,14H,2-3,5,9H2,1H3
InChIKeyRGSXBNWBDZSFON-UHFFFAOYSA-N
XLogP2.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol?
The IUPAC name of (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol (CID 174415170) is (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol.
What is the SMILES notation for (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol?
The canonical SMILES for (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol is CCC1=Cc2cc(CO)ccc2CC1.
What is the InChIKey of (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol?
The InChIKey is RGSXBNWBDZSFON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c1-2-10-3-5-12-6-4-11(9-14)8-13(12)7-10/h4,6-8,14H,2-3,5,9H2,1H3.
What are the key properties of (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol?
(7-ethyl-5,6-dihydronaphthalen-2-yl)methanol has a molecular weight of 188.27 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethyl-5,6-dihydronaphthalen-2-yl)methanol is sourced from PubChem (CID 174415170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).