2-trimethylstannylcyclopentene-1-carbaldehyde

C9H16OSn — CID 15370367

IUPAC2-trimethylstannylcyclopentene-1-carbaldehyde
SMILESC[Sn](C)(C)C1=C(C=O)CCC1
InChIInChI=1S/C6H7O.3CH3.Sn/c7-5-6-3-1-2-4-6;;;;/h5H,1-3H2;3*1H3;
InChIKeyRMNGLEWAALUNHV-UHFFFAOYSA-N
MW258.94 g/mol
LogP2.54
Rot. Bonds2

About 2-trimethylstannylcyclopentene-1-carbaldehyde

2-trimethylstannylcyclopentene-1-carbaldehyde (PubChem CID 15370367) has the molecular formula C9H16OSn and a molecular weight of 258.94 g/mol. Its IUPAC name is 2-trimethylstannylcyclopentene-1-carbaldehyde.

Molecular Properties

Compound Name2-trimethylstannylcyclopentene-1-carbaldehyde
PubChem CID15370367
Molecular FormulaC9H16OSn
Molecular Weight258.94 g/mol
Exact Mass260.02
IUPAC Name2-trimethylstannylcyclopentene-1-carbaldehyde
SMILESC[Sn](C)(C)C1=C(C=O)CCC1
InChIInChI=1S/C6H7O.3CH3.Sn/c7-5-6-3-1-2-4-6;;;;/h5H,1-3H2;3*1H3;
InChIKeyRMNGLEWAALUNHV-UHFFFAOYSA-N
XLogP2.54
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.94
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(cyclopentylidenemethyl)cyclohexene-1-carbaldehyde
CID 102254884
(3E)-3-(hydroxymethylidene)-2-methylcyclohexene-1-carbaldehyde
CID 58606979
2-methoxycycloheptene-1-carbaldehyde
CID 14143561
3,5,6,7-tetrahydro-2H-indene-4-carbaldehyde
CID 174827968
2,3,5,6,7,7a-hexahydro-1H-indene-4-carbaldehyde
CID 141417454
tert-butyl 2-(2-formylcyclopenten-1-yl)acetate
CID 14088604
2-trimethylsilylcyclopenta-1,3-diene-1-carbaldehyde
CID 15205236
2-(7-iodohepta-1,6-diynyl)cyclopentene-1-carbaldehyde
CID 11823083
2-(3-oxobutan-2-yl)cycloheptene-1-carbaldehyde
CID 12764656
2-[2-[(E)-prop-1-enyl]cyclopenten-1-yl]benzaldehyde
CID 10822441
2,3,4-trimethylcyclohexa-1,3-diene-1-carbaldehyde
CID 87516432
1,2-bis[(Z)-prop-1-enyl]cyclohexene;ethane
CID 144583134

Frequently Asked Questions

What is the IUPAC name of 2-trimethylstannylcyclopentene-1-carbaldehyde?
The IUPAC name of 2-trimethylstannylcyclopentene-1-carbaldehyde (CID 15370367) is 2-trimethylstannylcyclopentene-1-carbaldehyde.
What is the SMILES notation for 2-trimethylstannylcyclopentene-1-carbaldehyde?
The canonical SMILES for 2-trimethylstannylcyclopentene-1-carbaldehyde is C[Sn](C)(C)C1=C(C=O)CCC1.
What is the InChIKey of 2-trimethylstannylcyclopentene-1-carbaldehyde?
The InChIKey is RMNGLEWAALUNHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7O.3CH3.Sn/c7-5-6-3-1-2-4-6;;;;/h5H,1-3H2;3*1H3;.
What are the key properties of 2-trimethylstannylcyclopentene-1-carbaldehyde?
2-trimethylstannylcyclopentene-1-carbaldehyde has a molecular weight of 258.94 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-trimethylstannylcyclopentene-1-carbaldehyde is sourced from PubChem (CID 15370367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).