1-prop-2-enylfluoranthene

C19H14 — CID 173108316

IUPAC1-prop-2-enylfluoranthene
SMILESC=CCc1ccc2cccc3c2c1-c1ccccc1-3
InChIInChI=1S/C19H14/c1-2-6-13-11-12-14-7-5-10-17-15-8-3-4-9-16(15)18(13)19(14)17/h2-5,7-12H,1,6H2
InChIKeyQVESQBNQZCUOJC-UHFFFAOYSA-N
MW242.32 g/mol
LogP5.22
Rot. Bonds2

About 1-prop-2-enylfluoranthene

1-prop-2-enylfluoranthene (PubChem CID 173108316) has the molecular formula C19H14 and a molecular weight of 242.32 g/mol. Its IUPAC name is 1-prop-2-enylfluoranthene.

Molecular Properties

Compound Name1-prop-2-enylfluoranthene
PubChem CID173108316
Molecular FormulaC19H14
Molecular Weight242.32 g/mol
Exact Mass242.11
IUPAC Name1-prop-2-enylfluoranthene
SMILESC=CCc1ccc2cccc3c2c1-c1ccccc1-3
InChIInChI=1S/C19H14/c1-2-6-13-11-12-14-7-5-10-17-15-8-3-4-9-16(15)18(13)19(14)17/h2-5,7-12H,1,6H2
InChIKeyQVESQBNQZCUOJC-UHFFFAOYSA-N
XLogP5.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.32
LogP ≤ 55.22
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

2-[2,6-bis(prop-2-enyl)phenyl]-1,3-bis(prop-2-enyl)benzene
CID 173186666
anthracene-9,10-dione;1-prop-2-enylanthracene-9,10-dione
CID 174357555
1-(4-fluoranthen-1-ylnaphthalen-1-yl)fluoranthene
CID 139892613
formaldehyde;1-prop-2-enylnaphthalene
CID 69326534
fluoranthen-1-amine
CID 25756
1-prop-2-enyltetracene
CID 162689403
fluoranthene
CID 139203734
fluoranthen-1-yl prop-2-enoate
CID 164546686
2-(2-cyanophenyl)-3-prop-2-enylbenzonitrile
CID 66879284
2-(2-prop-2-enylphenyl)naphthalen-1-amine
CID 70019224
1-methyl-2,3-bis(2-prop-2-enylphenyl)benzene
CID 173365962
2-prop-2-enylpyrene
CID 173060600

Frequently Asked Questions

What is the IUPAC name of 1-prop-2-enylfluoranthene?
The IUPAC name of 1-prop-2-enylfluoranthene (CID 173108316) is 1-prop-2-enylfluoranthene.
What is the SMILES notation for 1-prop-2-enylfluoranthene?
The canonical SMILES for 1-prop-2-enylfluoranthene is C=CCc1ccc2cccc3c2c1-c1ccccc1-3.
What is the InChIKey of 1-prop-2-enylfluoranthene?
The InChIKey is QVESQBNQZCUOJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14/c1-2-6-13-11-12-14-7-5-10-17-15-8-3-4-9-16(15)18(13)19(14)17/h2-5,7-12H,1,6H2.
What are the key properties of 1-prop-2-enylfluoranthene?
1-prop-2-enylfluoranthene has a molecular weight of 242.32 g/mol, XLogP of 5.22, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enylfluoranthene is sourced from PubChem (CID 173108316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).