CID 152753145

C11H20SiTi- — CID 152753145

IUPAC—
SMILESC[SiH]C.Cc1[cH-]c(C)c(C)c1C.[Ti]
InChIInChI=1S/C9H13.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-3-2;/h5H,1-4H3;3H,1-2H3;/q-1;;
InChIKeyPKUFFJFSCWMFPS-UHFFFAOYSA-N
MW228.23 g/mol
LogP3.16
Rot. Bonds

About CID 152753145

CID 152753145 (PubChem CID 152753145) has the molecular formula C11H20SiTi- and a molecular weight of 228.23 g/mol.

Molecular Properties

Compound NameCID 152753145
PubChem CID152753145
Molecular FormulaC11H20SiTi-
Molecular Weight228.23 g/mol
Exact Mass228.08
IUPAC Name—
SMILESC[SiH]C.Cc1[cH-]c(C)c(C)c1C.[Ti]
InChIInChI=1S/C9H13.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-3-2;/h5H,1-4H3;3H,1-2H3;/q-1;;
InChIKeyPKUFFJFSCWMFPS-UHFFFAOYSA-N
XLogP3.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.23
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 152753145?
The IUPAC name of CID 152753145 (CID 152753145) is not available.
What is the SMILES notation for CID 152753145?
The canonical SMILES for CID 152753145 is C[SiH]C.Cc1[cH-]c(C)c(C)c1C.[Ti].
What is the InChIKey of CID 152753145?
The InChIKey is PKUFFJFSCWMFPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13.C2H7Si.Ti/c1-6-5-7(2)9(4)8(6)3;1-3-2;/h5H,1-4H3;3H,1-2H3;/q-1;;.
What are the key properties of CID 152753145?
CID 152753145 has a molecular weight of 228.23 g/mol, XLogP of 3.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 152753145 is sourced from PubChem (CID 152753145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).