(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene

C22H22O2 — CID 59318497

IUPAC(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene
SMILESCOCO[C@@H]1CC=c2ccccc2=C1c1cccc2c1=CCCC=2
InChIInChI=1S/C22H22O2/c1-23-15-24-21-14-13-17-8-3-5-11-19(17)22(21)20-12-6-9-16-7-2-4-10-18(16)20/h3,5-13,21H,2,4,14-15H2,1H3/t21-/m1/s1
InChIKeyDHRIOIWRKQCVJZ-OAQYLSRUSA-N
MW318.42 g/mol
LogP1.41
Rot. Bonds4

About (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene

(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene (PubChem CID 59318497) has the molecular formula C22H22O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene.

Molecular Properties

Compound Name(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene
PubChem CID59318497
Molecular FormulaC22H22O2
Molecular Weight318.42 g/mol
Exact Mass318.16
IUPAC Name(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene
SMILESCOCO[C@@H]1CC=c2ccccc2=C1c1cccc2c1=CCCC=2
InChIInChI=1S/C22H22O2/c1-23-15-24-21-14-13-17-8-3-5-11-19(17)22(21)20-12-6-9-16-7-2-4-10-18(16)20/h3,5-13,21H,2,4,14-15H2,1H3/t21-/m1/s1
InChIKeyDHRIOIWRKQCVJZ-OAQYLSRUSA-N
XLogP1.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene?
The IUPAC name of (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene (CID 59318497) is (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene.
What is the SMILES notation for (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene?
The canonical SMILES for (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene is COCO[C@@H]1CC=c2ccccc2=C1c1cccc2c1=CCCC=2.
What is the InChIKey of (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene?
The InChIKey is DHRIOIWRKQCVJZ-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H22O2/c1-23-15-24-21-14-13-17-8-3-5-11-19(17)22(21)20-12-6-9-16-7-2-4-10-18(16)20/h3,5-13,21H,2,4,14-15H2,1H3/t21-/m1/s1.
What are the key properties of (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene?
(2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene has a molecular weight of 318.42 g/mol, XLogP of 1.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(6,7-dihydronaphthalen-1-yl)-2-(methoxymethoxy)-2,3-dihydronaphthalene is sourced from PubChem (CID 59318497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).