oxirane;1-prop-2-enoxynaphthalene

C15H16O2 — CID 174790954

IUPACoxirane;1-prop-2-enoxynaphthalene
SMILESC1CO1.C=CCOc1cccc2ccccc12
InChIInChI=1S/C13H12O.C2H4O/c1-2-10-14-13-9-5-7-11-6-3-4-8-12(11)13;1-2-3-1/h2-9H,1,10H2;1-2H2
InChIKeyYSPVQOLUDXFRPD-UHFFFAOYSA-N
MW228.29 g/mol
LogP3.42
Rot. Bonds3

About oxirane;1-prop-2-enoxynaphthalene

oxirane;1-prop-2-enoxynaphthalene (PubChem CID 174790954) has the molecular formula C15H16O2 and a molecular weight of 228.29 g/mol. Its IUPAC name is oxirane;1-prop-2-enoxynaphthalene.

Molecular Properties

Compound Nameoxirane;1-prop-2-enoxynaphthalene
PubChem CID174790954
Molecular FormulaC15H16O2
Molecular Weight228.29 g/mol
Exact Mass228.12
IUPAC Nameoxirane;1-prop-2-enoxynaphthalene
SMILESC1CO1.C=CCOc1cccc2ccccc12
InChIInChI=1S/C13H12O.C2H4O/c1-2-10-14-13-9-5-7-11-6-3-4-8-12(11)13;1-2-3-1/h2-9H,1,10H2;1-2H2
InChIKeyYSPVQOLUDXFRPD-UHFFFAOYSA-N
XLogP3.42
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-prop-2-enoxyanthracene
CID 141089148
naphthalen-1-yloxy-oxo-prop-2-enoxyphosphanium
CID 174568818
1-naphthalen-1-yloxy-3-(4-prop-2-enylmorpholin-4-ium-4-yl)propan-2-ol
CID 3064908
1-methoxy-2,3-bis(prop-2-enoxy)benzene
CID 11160335
1-methoxynaphthalene;oxetane
CID 90030663
4-naphthalen-1-yloxy-N-prop-2-enylbutan-1-amine
CID 2249610
7-ethenoxy-1-prop-2-enoxynaphthalene
CID 164732321
4-(2-naphthalen-1-yloxyethyl)morpholin-4-ium
CID 7074084
2-naphthalen-1-yloxy-N-[(2-prop-2-enoxyphenyl)methylideneamino]acetamide
CID 5146586
4-[(2-prop-2-enoxyphenyl)methyl]morpholin-4-ium
CID 2244994
(2-prop-2-enoxyphenyl)methanol
CID 11137475
2,3-bis(prop-2-enoxy)benzonitrile
CID 118571042

Frequently Asked Questions

What is the IUPAC name of oxirane;1-prop-2-enoxynaphthalene?
The IUPAC name of oxirane;1-prop-2-enoxynaphthalene (CID 174790954) is oxirane;1-prop-2-enoxynaphthalene.
What is the SMILES notation for oxirane;1-prop-2-enoxynaphthalene?
The canonical SMILES for oxirane;1-prop-2-enoxynaphthalene is C1CO1.C=CCOc1cccc2ccccc12.
What is the InChIKey of oxirane;1-prop-2-enoxynaphthalene?
The InChIKey is YSPVQOLUDXFRPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12O.C2H4O/c1-2-10-14-13-9-5-7-11-6-3-4-8-12(11)13;1-2-3-1/h2-9H,1,10H2;1-2H2.
What are the key properties of oxirane;1-prop-2-enoxynaphthalene?
oxirane;1-prop-2-enoxynaphthalene has a molecular weight of 228.29 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxirane;1-prop-2-enoxynaphthalene is sourced from PubChem (CID 174790954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).