4,4-bis(prop-2-enyl)-1H-naphthalene

C16H18 — CID 10353080

IUPAC4,4-bis(prop-2-enyl)-1H-naphthalene
SMILESC=CCC1(CC=C)C=CCc2ccccc21
InChIInChI=1S/C16H18/c1-3-11-16(12-4-2)13-7-9-14-8-5-6-10-15(14)16/h3-8,10,13H,1-2,9,11-12H2
InChIKeyIMJYWXHNEXBQBR-UHFFFAOYSA-N
MW210.32 g/mol
LogP4.19
Rot. Bonds4

About 4,4-bis(prop-2-enyl)-1H-naphthalene

4,4-bis(prop-2-enyl)-1H-naphthalene (PubChem CID 10353080) has the molecular formula C16H18 and a molecular weight of 210.32 g/mol. Its IUPAC name is 4,4-bis(prop-2-enyl)-1H-naphthalene.

Molecular Properties

Compound Name4,4-bis(prop-2-enyl)-1H-naphthalene
PubChem CID10353080
Molecular FormulaC16H18
Molecular Weight210.32 g/mol
Exact Mass210.14
IUPAC Name4,4-bis(prop-2-enyl)-1H-naphthalene
SMILESC=CCC1(CC=C)C=CCc2ccccc21
InChIInChI=1S/C16H18/c1-3-11-16(12-4-2)13-7-9-14-8-5-6-10-15(14)16/h3-8,10,13H,1-2,9,11-12H2
InChIKeyIMJYWXHNEXBQBR-UHFFFAOYSA-N
XLogP4.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4,4-bis[(4-chlorophenyl)methyl]-1H-naphthalene
CID 10317549
(7R)-7-prop-2-enylbicyclo[4.2.0]octa-1,3,5-trien-7-ol
CID 100988172
3-methyl-3-prop-2-enyl-1,2-dihydroindene
CID 85427456
3,3,4,4-tetrakis(prop-2-enyl)-1,2-dihydronaphthalene
CID 173371645
(E)-3-(2-prop-2-enyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaenyl)prop-2-en-1-ol
CID 19079047
(1S)-1-propyl-4H-naphthalene-1-carbaldehyde
CID 11008955
spiro[1H-naphthalene-4,4'-piperidine]
CID 22012177
1-(2-ethenyl-1,3-dihydroinden-2-yl)-1,3,3-tris(prop-2-enyl)-2H-indene
CID 173092791
2-N,2-N-diethyl-1-prop-2-enyl-2,3-dihydroindene-1,2-diamine
CID 43831011
dimethyl 4H-naphthalene-1,1-dicarboxylate
CID 14462724
3-(1H-inden-2-yl)-3-prop-2-enyl-1H-inden-2-one
CID 18368433
7-ethenyl-7-methylbicyclo[4.2.0]octa-1,3,5-triene
CID 2753008

Frequently Asked Questions

What is the IUPAC name of 4,4-bis(prop-2-enyl)-1H-naphthalene?
The IUPAC name of 4,4-bis(prop-2-enyl)-1H-naphthalene (CID 10353080) is 4,4-bis(prop-2-enyl)-1H-naphthalene.
What is the SMILES notation for 4,4-bis(prop-2-enyl)-1H-naphthalene?
The canonical SMILES for 4,4-bis(prop-2-enyl)-1H-naphthalene is C=CCC1(CC=C)C=CCc2ccccc21.
What is the InChIKey of 4,4-bis(prop-2-enyl)-1H-naphthalene?
The InChIKey is IMJYWXHNEXBQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18/c1-3-11-16(12-4-2)13-7-9-14-8-5-6-10-15(14)16/h3-8,10,13H,1-2,9,11-12H2.
What are the key properties of 4,4-bis(prop-2-enyl)-1H-naphthalene?
4,4-bis(prop-2-enyl)-1H-naphthalene has a molecular weight of 210.32 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-bis(prop-2-enyl)-1H-naphthalene is sourced from PubChem (CID 10353080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).