CID 134831207

C18H29O2Si — CID 134831207

IUPAC—
SMILESCO[C@H]1/[C]=C2/C[Si](C)(C)OC2C/C(C)=C\CC(C)(C)/C=C/1
InChIInChI=1S/C18H29O2Si/c1-14-7-9-18(2,3)10-8-16(19-4)12-15-13-21(5,6)20-17(15)11-14/h7-8,10,16-17H,9,11,13H2,1-6H3/b10-8+,14-7-,15-12?/t16-,17?/m1/s1
InChIKeyYEVLRMMDUHQONH-DBQYILNSSA-N
MW305.51 g/mol
LogP4.66
Rot. Bonds1

About CID 134831207

CID 134831207 (PubChem CID 134831207) has the molecular formula C18H29O2Si and a molecular weight of 305.51 g/mol.

Molecular Properties

Compound NameCID 134831207
PubChem CID134831207
Molecular FormulaC18H29O2Si
Molecular Weight305.51 g/mol
Exact Mass305.19
IUPAC Name—
SMILESCO[C@H]1/[C]=C2/C[Si](C)(C)OC2C/C(C)=C\CC(C)(C)/C=C/1
InChIInChI=1S/C18H29O2Si/c1-14-7-9-18(2,3)10-8-16(19-4)12-15-13-21(5,6)20-17(15)11-14/h7-8,10,16-17H,9,11,13H2,1-6H3/b10-8+,14-7-,15-12?/t16-,17?/m1/s1
InChIKeyYEVLRMMDUHQONH-DBQYILNSSA-N
XLogP4.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.51
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134831207?
The IUPAC name of CID 134831207 (CID 134831207) is not available.
What is the SMILES notation for CID 134831207?
The canonical SMILES for CID 134831207 is CO[C@H]1/[C]=C2/C[Si](C)(C)OC2C/C(C)=C\CC(C)(C)/C=C/1.
What is the InChIKey of CID 134831207?
The InChIKey is YEVLRMMDUHQONH-DBQYILNSSA-N. The full InChI is InChI=1S/C18H29O2Si/c1-14-7-9-18(2,3)10-8-16(19-4)12-15-13-21(5,6)20-17(15)11-14/h7-8,10,16-17H,9,11,13H2,1-6H3/b10-8+,14-7-,15-12?/t16-,17?/m1/s1.
What are the key properties of CID 134831207?
CID 134831207 has a molecular weight of 305.51 g/mol, XLogP of 4.66, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134831207 is sourced from PubChem (CID 134831207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).