2-ethenyl-1,2,3,4-tetrahydronaphthalene

C12H14 — CID 18314182

IUPAC2-ethenyl-1,2,3,4-tetrahydronaphthalene
SMILESC=CC1CCc2ccccc2C1
InChIInChI=1S/C12H14/c1-2-10-7-8-11-5-3-4-6-12(11)9-10/h2-6,10H,1,7-9H2
InChIKeyRAFREZFIGVYLOH-UHFFFAOYSA-N
MW158.24 g/mol
LogP2.98
Rot. Bonds1

About 2-ethenyl-1,2,3,4-tetrahydronaphthalene

2-ethenyl-1,2,3,4-tetrahydronaphthalene (PubChem CID 18314182) has the molecular formula C12H14 and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-ethenyl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name2-ethenyl-1,2,3,4-tetrahydronaphthalene
PubChem CID18314182
Molecular FormulaC12H14
Molecular Weight158.24 g/mol
Exact Mass158.11
IUPAC Name2-ethenyl-1,2,3,4-tetrahydronaphthalene
SMILESC=CC1CCc2ccccc2C1
InChIInChI=1S/C12H14/c1-2-10-7-8-11-5-3-4-6-12(11)9-10/h2-6,10H,1,7-9H2
InChIKeyRAFREZFIGVYLOH-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 52.98
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

(2S)-2-prop-2-enyl-1,2,3,4-tetrahydronaphthalene
CID 129383765
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]azanium
CID 40572503
(2S)-2-[(3E)-hexa-1,3,5-trien-3-yl]-1,2,3,4-tetrahydronaphthalene
CID 145371649
benzene;1,2,3,4-tetrahydronaphthalen-2-amine
CID 66647094
1,2,3,4-tetrahydronaphthalen-2-amine;trihydrochloride
CID 67686398
2-[(3Z)-hexa-1,3,5-trien-2-yl]-1,2,3,4-tetrahydronaphthalene
CID 142076655
N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)but-3-en-1-amine
CID 65405177
1,2,3,4-tetrahydronaphthalen-2-yl formate
CID 88796970
(2S)-2-ethenyl-3,4-dihydro-2H-chromene
CID 57124320
[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]methanamine
CID 86313684
(6S,7S)-7-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ol
CID 53322291
ethane;2-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 142915182

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 2-ethenyl-1,2,3,4-tetrahydronaphthalene (CID 18314182) is 2-ethenyl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 2-ethenyl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 2-ethenyl-1,2,3,4-tetrahydronaphthalene is C=CC1CCc2ccccc2C1.
What is the InChIKey of 2-ethenyl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is RAFREZFIGVYLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14/c1-2-10-7-8-11-5-3-4-6-12(11)9-10/h2-6,10H,1,7-9H2.
What are the key properties of 2-ethenyl-1,2,3,4-tetrahydronaphthalene?
2-ethenyl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 158.24 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 18314182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).