(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde

C8H15OP — CID 59961076

IUPAC(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde
SMILESCP(C)[C@H]1CCCC1C=O
InChIInChI=1S/C8H15OP/c1-10(2)8-5-3-4-7(8)6-9/h6-8H,3-5H2,1-2H3/t7?,8-/m0/s1
InChIKeyFSCZSGAKYVJNCL-MQWKRIRWSA-N
MW158.18 g/mol
LogP2.10
Rot. Bonds2

About (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde

(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde (PubChem CID 59961076) has the molecular formula C8H15OP and a molecular weight of 158.18 g/mol. Its IUPAC name is (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde.

Molecular Properties

Compound Name(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde
PubChem CID59961076
Molecular FormulaC8H15OP
Molecular Weight158.18 g/mol
Exact Mass158.09
IUPAC Name(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde
SMILESCP(C)[C@H]1CCCC1C=O
InChIInChI=1S/C8H15OP/c1-10(2)8-5-3-4-7(8)6-9/h6-8H,3-5H2,1-2H3/t7?,8-/m0/s1
InChIKeyFSCZSGAKYVJNCL-MQWKRIRWSA-N
XLogP2.10
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.18
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde?
The IUPAC name of (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde (CID 59961076) is (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde.
What is the SMILES notation for (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde?
The canonical SMILES for (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde is CP(C)[C@H]1CCCC1C=O.
What is the InChIKey of (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde?
The InChIKey is FSCZSGAKYVJNCL-MQWKRIRWSA-N. The full InChI is InChI=1S/C8H15OP/c1-10(2)8-5-3-4-7(8)6-9/h6-8H,3-5H2,1-2H3/t7?,8-/m0/s1.
What are the key properties of (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde?
(2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde has a molecular weight of 158.18 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-dimethylphosphanylcyclopentane-1-carbaldehyde is sourced from PubChem (CID 59961076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).