cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde

C7H14OSi — CID 45083467

IUPACcis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde
SMILESC[Si](C)(C)[C@@H]1C[C@H]1C=O
InChIInChI=1S/C7H14OSi/c1-9(2,3)7-4-6(7)5-8/h5-7H,4H2,1-3H3/t6-,7+/m0/s1
InChIKeyBEZSLPRPTOOYGF-NKWVEPMBSA-N
MW142.27 g/mol
LogP1.91
Rot. Bonds2

About cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde

cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde (PubChem CID 45083467) has the molecular formula C7H14OSi and a molecular weight of 142.27 g/mol. Its IUPAC name is cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde.

Molecular Properties

Compound Namecis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde
PubChem CID45083467
Molecular FormulaC7H14OSi
Molecular Weight142.27 g/mol
Exact Mass142.08
IUPAC Namecis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde
SMILESC[Si](C)(C)[C@@H]1C[C@H]1C=O
InChIInChI=1S/C7H14OSi/c1-9(2,3)7-4-6(7)5-8/h5-7H,4H2,1-3H3/t6-,7+/m0/s1
InChIKeyBEZSLPRPTOOYGF-NKWVEPMBSA-N
XLogP1.91
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.27
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde?
The IUPAC name of cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde (CID 45083467) is cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde.
What is the SMILES notation for cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde?
The canonical SMILES for cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde is C[Si](C)(C)[C@@H]1C[C@H]1C=O.
What is the InChIKey of cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde?
The InChIKey is BEZSLPRPTOOYGF-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H14OSi/c1-9(2,3)7-4-6(7)5-8/h5-7H,4H2,1-3H3/t6-,7+/m0/s1.
What are the key properties of cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde?
cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde has a molecular weight of 142.27 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1S,2R)-2-trimethylsilylcyclopropane-1-carbaldehyde is sourced from PubChem (CID 45083467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).