1-chloro-9,9-bis(prop-2-enyl)fluorene

C19H17Cl — CID 174649432

IUPAC1-chloro-9,9-bis(prop-2-enyl)fluorene
SMILESC=CCC1(CC=C)c2ccccc2-c2cccc(Cl)c21
InChIInChI=1S/C19H17Cl/c1-3-12-19(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(20)18(15)19/h3-11H,1-2,12-13H2
InChIKeyDADAKJVAVFTXHP-UHFFFAOYSA-N
MW280.80 g/mol
LogP5.76
Rot. Bonds4

About 1-chloro-9,9-bis(prop-2-enyl)fluorene

1-chloro-9,9-bis(prop-2-enyl)fluorene (PubChem CID 174649432) has the molecular formula C19H17Cl and a molecular weight of 280.80 g/mol. Its IUPAC name is 1-chloro-9,9-bis(prop-2-enyl)fluorene.

Molecular Properties

Compound Name1-chloro-9,9-bis(prop-2-enyl)fluorene
PubChem CID174649432
Molecular FormulaC19H17Cl
Molecular Weight280.80 g/mol
Exact Mass280.10
IUPAC Name1-chloro-9,9-bis(prop-2-enyl)fluorene
SMILESC=CCC1(CC=C)c2ccccc2-c2cccc(Cl)c21
InChIInChI=1S/C19H17Cl/c1-3-12-19(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(20)18(15)19/h3-11H,1-2,12-13H2
InChIKeyDADAKJVAVFTXHP-UHFFFAOYSA-N
XLogP5.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.80
LogP ≤ 55.76
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

9,9,18,18,27,27-hexakis(prop-2-enyl)heptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3,5,7,10,12,14,16,19,21,23,25-dodecaene
CID 11628484
2-(9-prop-2-enylfluoren-9-yl)ethanol
CID 11391058
1-(2-chlorophenyl)-9,9'-spirobi[fluorene]
CID 130380139
4,4-bis(prop-2-enyl)-2H-cyclopenta[a]indene;methane
CID 143545860
1-[9,9-bis(prop-2-enyl)fluoren-2-yl]propan-2-one
CID 174822962
9-prop-2-enyl-9-undec-2-enylfluorene
CID 91593860
9-prop-2-enyl-9-tridec-2-enylfluorene
CID 91376717
3-[10,10-bis(prop-2-enyl)anthracen-9-ylidene]-N,N-dimethylpropan-1-amine
CID 1203583
3-methylidene-1-prop-2-enyl-2H-inden-1-ol
CID 86041926
6,12-dimethyl-6,12-bis(prop-2-enyl)indeno[1,2-b]fluorene
CID 155763593
(10-oxo-9-prop-2-enylthioxanthen-9-yl)methanol
CID 125463645
3-hydroxy-3-prop-2-enyl-2H-isoindol-1-one
CID 14902933

Frequently Asked Questions

What is the IUPAC name of 1-chloro-9,9-bis(prop-2-enyl)fluorene?
The IUPAC name of 1-chloro-9,9-bis(prop-2-enyl)fluorene (CID 174649432) is 1-chloro-9,9-bis(prop-2-enyl)fluorene.
What is the SMILES notation for 1-chloro-9,9-bis(prop-2-enyl)fluorene?
The canonical SMILES for 1-chloro-9,9-bis(prop-2-enyl)fluorene is C=CCC1(CC=C)c2ccccc2-c2cccc(Cl)c21.
What is the InChIKey of 1-chloro-9,9-bis(prop-2-enyl)fluorene?
The InChIKey is DADAKJVAVFTXHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17Cl/c1-3-12-19(13-4-2)16-10-6-5-8-14(16)15-9-7-11-17(20)18(15)19/h3-11H,1-2,12-13H2.
What are the key properties of 1-chloro-9,9-bis(prop-2-enyl)fluorene?
1-chloro-9,9-bis(prop-2-enyl)fluorene has a molecular weight of 280.80 g/mol, XLogP of 5.76, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-9,9-bis(prop-2-enyl)fluorene is sourced from PubChem (CID 174649432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).