CID 135023002

C7H10OSi+ — CID 135023002

IUPAC—
SMILESC=C=C([Si])C(C)O[CH+]C
InChIInChI=1S/C7H10OSi/c1-4-7(9)6(3)8-5-2/h5-6H,1H2,2-3H3/q+1
InChIKeyLVQHETUTCSWKRN-UHFFFAOYSA-N
MW138.24 g/mol
LogP1.41
Rot. Bonds3

About CID 135023002

CID 135023002 (PubChem CID 135023002) has the molecular formula C7H10OSi+ and a molecular weight of 138.24 g/mol.

Molecular Properties

Compound NameCID 135023002
PubChem CID135023002
Molecular FormulaC7H10OSi+
Molecular Weight138.24 g/mol
Exact Mass138.05
IUPAC Name—
SMILESC=C=C([Si])C(C)O[CH+]C
InChIInChI=1S/C7H10OSi/c1-4-7(9)6(3)8-5-2/h5-6H,1H2,2-3H3/q+1
InChIKeyLVQHETUTCSWKRN-UHFFFAOYSA-N
XLogP1.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.24
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 135023002?
The IUPAC name of CID 135023002 (CID 135023002) is not available.
What is the SMILES notation for CID 135023002?
The canonical SMILES for CID 135023002 is C=C=C([Si])C(C)O[CH+]C.
What is the InChIKey of CID 135023002?
The InChIKey is LVQHETUTCSWKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10OSi/c1-4-7(9)6(3)8-5-2/h5-6H,1H2,2-3H3/q+1.
What are the key properties of CID 135023002?
CID 135023002 has a molecular weight of 138.24 g/mol, XLogP of 1.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 135023002 is sourced from PubChem (CID 135023002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).