formaldehyde;1-prop-2-enylnaphthalene

C14H14O — CID 69326534

IUPACformaldehyde;1-prop-2-enylnaphthalene
SMILESC=CCc1cccc2ccccc12.C=O
InChIInChI=1S/C13H12.CH2O/c1-2-6-11-8-5-9-12-7-3-4-10-13(11)12;1-2/h2-5,7-10H,1,6H2;1H2
InChIKeyLZVLOPNFKKJZDE-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.38
Rot. Bonds2

About formaldehyde;1-prop-2-enylnaphthalene

formaldehyde;1-prop-2-enylnaphthalene (PubChem CID 69326534) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is formaldehyde;1-prop-2-enylnaphthalene.

Molecular Properties

Compound Nameformaldehyde;1-prop-2-enylnaphthalene
PubChem CID69326534
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Nameformaldehyde;1-prop-2-enylnaphthalene
SMILESC=CCc1cccc2ccccc12.C=O
InChIInChI=1S/C13H12.CH2O/c1-2-6-11-8-5-9-12-7-3-4-10-13(11)12;1-2/h2-5,7-10H,1,6H2;1H2
InChIKeyLZVLOPNFKKJZDE-UHFFFAOYSA-N
XLogP3.38
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of formaldehyde;1-prop-2-enylnaphthalene?
The IUPAC name of formaldehyde;1-prop-2-enylnaphthalene (CID 69326534) is formaldehyde;1-prop-2-enylnaphthalene.
What is the SMILES notation for formaldehyde;1-prop-2-enylnaphthalene?
The canonical SMILES for formaldehyde;1-prop-2-enylnaphthalene is C=CCc1cccc2ccccc12.C=O.
What is the InChIKey of formaldehyde;1-prop-2-enylnaphthalene?
The InChIKey is LZVLOPNFKKJZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12.CH2O/c1-2-6-11-8-5-9-12-7-3-4-10-13(11)12;1-2/h2-5,7-10H,1,6H2;1H2.
What are the key properties of formaldehyde;1-prop-2-enylnaphthalene?
formaldehyde;1-prop-2-enylnaphthalene has a molecular weight of 198.26 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;1-prop-2-enylnaphthalene is sourced from PubChem (CID 69326534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).