1,2-bis(2-methylprop-2-enoxy)naphthalene

C18H20O2 — CID 139631746

IUPAC1,2-bis(2-methylprop-2-enoxy)naphthalene
SMILESC=C(C)COc1ccc2ccccc2c1OCC(=C)C
InChIInChI=1S/C18H20O2/c1-13(2)11-19-17-10-9-15-7-5-6-8-16(15)18(17)20-12-14(3)4/h5-10H,1,3,11-12H2,2,4H3
InChIKeyMYKRHAIJZZNZDV-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.75
Rot. Bonds6

About 1,2-bis(2-methylprop-2-enoxy)naphthalene

1,2-bis(2-methylprop-2-enoxy)naphthalene (PubChem CID 139631746) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 1,2-bis(2-methylprop-2-enoxy)naphthalene.

Molecular Properties

Compound Name1,2-bis(2-methylprop-2-enoxy)naphthalene
PubChem CID139631746
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name1,2-bis(2-methylprop-2-enoxy)naphthalene
SMILESC=C(C)COc1ccc2ccccc2c1OCC(=C)C
InChIInChI=1S/C18H20O2/c1-13(2)11-19-17-10-9-15-7-5-6-8-16(15)18(17)20-12-14(3)4/h5-10H,1,3,11-12H2,2,4H3
InChIKeyMYKRHAIJZZNZDV-UHFFFAOYSA-N
XLogP4.75
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1,2-bis(2-methylprop-2-enoxy)benzene
CID 10878622
2-(2-methylprop-2-enoxy)naphthalene-1-carbaldehyde
CID 4737132
trifluoro-[2-(2-methylprop-2-enoxy)naphthalen-1-yl]boranuide
CID 63677261
2-[[2-(2-methylprop-2-enoxy)naphthalen-1-yl]methylamino]butan-1-ol
CID 54849156
1-methyl-2-(2-methylprop-2-enoxy)benzene
CID 4157656
N-[[2-(2-methylprop-2-enoxy)naphthalen-1-yl]methyl]-1-(4-propan-2-yloxyphenyl)methanamine
CID 54848912
1-bromo-2-(3-methylbut-3-enoxy)naphthalene
CID 114472659
1-iodo-2-(2-phenylprop-2-enoxy)naphthalene
CID 154574124
1-[1-(2-chloroprop-2-enoxy)naphthalen-2-yl]ethanone
CID 43388554
1-(2-methylprop-2-enoxy)-2-phenylbenzene
CID 70267118
chrysene;2-methylprop-1-ene
CID 173244266
methyl 2-(2,3-dimethylbut-2-enoxy)naphthalene-1-carboxylate
CID 102438824

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(2-methylprop-2-enoxy)naphthalene?
The IUPAC name of 1,2-bis(2-methylprop-2-enoxy)naphthalene (CID 139631746) is 1,2-bis(2-methylprop-2-enoxy)naphthalene.
What is the SMILES notation for 1,2-bis(2-methylprop-2-enoxy)naphthalene?
The canonical SMILES for 1,2-bis(2-methylprop-2-enoxy)naphthalene is C=C(C)COc1ccc2ccccc2c1OCC(=C)C.
What is the InChIKey of 1,2-bis(2-methylprop-2-enoxy)naphthalene?
The InChIKey is MYKRHAIJZZNZDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-13(2)11-19-17-10-9-15-7-5-6-8-16(15)18(17)20-12-14(3)4/h5-10H,1,3,11-12H2,2,4H3.
What are the key properties of 1,2-bis(2-methylprop-2-enoxy)naphthalene?
1,2-bis(2-methylprop-2-enoxy)naphthalene has a molecular weight of 268.36 g/mol, XLogP of 4.75, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(2-methylprop-2-enoxy)naphthalene is sourced from PubChem (CID 139631746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).