1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene

C16H16O — CID 11075061

IUPAC1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene
SMILESC=C1c2cccc3cccc(c23)C1(C)COC
InChIInChI=1S/C16H16O/c1-11-13-8-4-6-12-7-5-9-14(15(12)13)16(11,2)10-17-3/h4-9H,1,10H2,2-3H3
InChIKeyCHWYPTGWDSHALE-UHFFFAOYSA-N
MW224.30 g/mol
LogP3.77
Rot. Bonds2

About 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene

1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene (PubChem CID 11075061) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene.

Molecular Properties

Compound Name1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene
PubChem CID11075061
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene
SMILESC=C1c2cccc3cccc(c23)C1(C)COC
InChIInChI=1S/C16H16O/c1-11-13-8-4-6-12-7-5-9-14(15(12)13)16(11,2)10-17-3/h4-9H,1,10H2,2-3H3
InChIKeyCHWYPTGWDSHALE-UHFFFAOYSA-N
XLogP3.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene?
The IUPAC name of 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene (CID 11075061) is 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene.
What is the SMILES notation for 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene?
The canonical SMILES for 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene is C=C1c2cccc3cccc(c23)C1(C)COC.
What is the InChIKey of 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene?
The InChIKey is CHWYPTGWDSHALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-11-13-8-4-6-12-7-5-9-14(15(12)13)16(11,2)10-17-3/h4-9H,1,10H2,2-3H3.
What are the key properties of 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene?
1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene has a molecular weight of 224.30 g/mol, XLogP of 3.77, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-1-methyl-2-methylideneacenaphthylene is sourced from PubChem (CID 11075061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).