spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]

C12H14O2 — CID 11401254

IUPACspiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]
SMILESc1ccc2c(c1)CCCC21OCCO1
InChIInChI=1S/C12H14O2/c1-2-6-11-10(4-1)5-3-7-12(11)13-8-9-14-12/h1-2,4,6H,3,5,7-9H2
InChIKeyUGZFAEQGTWNPDV-UHFFFAOYSA-N
MW190.24 g/mol
LogP2.22
Rot. Bonds

About spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]

spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene] (PubChem CID 11401254) has the molecular formula C12H14O2 and a molecular weight of 190.24 g/mol. Its IUPAC name is spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene].

Molecular Properties

Compound Namespiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]
PubChem CID11401254
Molecular FormulaC12H14O2
Molecular Weight190.24 g/mol
Exact Mass190.10
IUPAC Namespiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]
SMILESc1ccc2c(c1)CCCC21OCCO1
InChIInChI=1S/C12H14O2/c1-2-6-11-10(4-1)5-3-7-12(11)13-8-9-14-12/h1-2,4,6H,3,5,7-9H2
InChIKeyUGZFAEQGTWNPDV-UHFFFAOYSA-N
XLogP2.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-Dioxolane, 2-methyl-4-phenyl-
CID 118119
2-Phenyl-1,3-dioxolane
CID 70293
1,3-Dioxolane, 2,4-dimethyl-2-(5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthalenyl)-
CID 3034278
2-Methyl-2-phenyl-1,3-dioxolane
CID 138006
4-Phenyl-1,3-dioxolane
CID 70634
1,4-Dioxaspiro[4.5]decane, 2-phenyl-
CID 97830
4-Phenyl-1,3-dioxolan-2-one
CID 234226
2,2-Diphenyldioxolane
CID 283230
2,2-Dimethyl-4-phenyl-1,3-dioxolane
CID 537869
Spiro[1,5-dihydro-2,4-benzodioxepine-3,1'-cyclohexane]
CID 10560784
2,2-Bis(4-methylphenyl)-1,3-dioxolane
CID 53996432
1,4-Epoxy-1,2,3,4-tetrahydronaphthalene
CID 141969

Frequently Asked Questions

What is the IUPAC name of spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]?
The IUPAC name of spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene] (CID 11401254) is spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene].
What is the SMILES notation for spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]?
The canonical SMILES for spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene] is c1ccc2c(c1)CCCC21OCCO1.
What is the InChIKey of spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]?
The InChIKey is UGZFAEQGTWNPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O2/c1-2-6-11-10(4-1)5-3-7-12(11)13-8-9-14-12/h1-2,4,6H,3,5,7-9H2.
What are the key properties of spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene]?
spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene] has a molecular weight of 190.24 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,3-dioxolane-2,4'-2,3-dihydro-1H-naphthalene] is sourced from PubChem (CID 11401254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).