8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene

C14H18O — CID 12784473

IUPAC8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene
SMILESC=C1c2cccc(OC)c2CCC1(C)C
InChIInChI=1S/C14H18O/c1-10-11-6-5-7-13(15-4)12(11)8-9-14(10,2)3/h5-7H,1,8-9H2,2-4H3
InChIKeyRCTNSECUKYFRBR-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.68
Rot. Bonds1

About 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene

8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene (PubChem CID 12784473) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene.

Molecular Properties

Compound Name8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene
PubChem CID12784473
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene
SMILESC=C1c2cccc(OC)c2CCC1(C)C
InChIInChI=1S/C14H18O/c1-10-11-6-5-7-13(15-4)12(11)8-9-14(10,2)3/h5-7H,1,8-9H2,2-4H3
InChIKeyRCTNSECUKYFRBR-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene?
The IUPAC name of 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene (CID 12784473) is 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene.
What is the SMILES notation for 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene?
The canonical SMILES for 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene is C=C1c2cccc(OC)c2CCC1(C)C.
What is the InChIKey of 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene?
The InChIKey is RCTNSECUKYFRBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-10-11-6-5-7-13(15-4)12(11)8-9-14(10,2)3/h5-7H,1,8-9H2,2-4H3.
What are the key properties of 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene?
8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene has a molecular weight of 202.30 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-3,3-dimethyl-4-methylidene-1,2-dihydronaphthalene is sourced from PubChem (CID 12784473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).