CID 134902405

C19H23OTb — CID 134902405

IUPAC—
SMILESC1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Tb]
InChIInChI=1S/3C5H5.C4H8O.Tb/c4*1-2-4-5-3-1;/h3*1-5H;1-4H2;
InChIKeyITERECODFLOUND-UHFFFAOYSA-N
MW426.32 g/mol
LogP3.86
Rot. Bonds

About CID 134902405

CID 134902405 (PubChem CID 134902405) has the molecular formula C19H23OTb and a molecular weight of 426.32 g/mol.

Molecular Properties

Compound NameCID 134902405
PubChem CID134902405
Molecular FormulaC19H23OTb
Molecular Weight426.32 g/mol
Exact Mass426.10
IUPAC Name—
SMILESC1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Tb]
InChIInChI=1S/3C5H5.C4H8O.Tb/c4*1-2-4-5-3-1;/h3*1-5H;1-4H2;
InChIKeyITERECODFLOUND-UHFFFAOYSA-N
XLogP3.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.32
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

CID 134902491
CID 134902491
1,6,11,16,21,26,31-heptaoxacyclopentatriacontane
CID 15446455
1,6,11,16,21,26,31,36,41,46-decaoxacyclopentacontane
CID 15446458
CID 135046697
CID 135046697
oxolane;titanium
CID 160710512
oxacycloheptadecane
CID 22011753
manganese;oxolane
CID 70504486
1,5,10,14-tetraoxacyclooctadecane
CID 57048709
oxane;oxepane;oxocane;oxolane
CID 159745968
cycloheptane;oxolane
CID 23033083
oxolane;oxonane
CID 159283889
cyclohexane;oxane
CID 20574508

Frequently Asked Questions

What is the IUPAC name of CID 134902405?
The IUPAC name of CID 134902405 (CID 134902405) is not available.
What is the SMILES notation for CID 134902405?
The canonical SMILES for CID 134902405 is C1CCOC1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Tb].
What is the InChIKey of CID 134902405?
The InChIKey is ITERECODFLOUND-UHFFFAOYSA-N. The full InChI is InChI=1S/3C5H5.C4H8O.Tb/c4*1-2-4-5-3-1;/h3*1-5H;1-4H2;.
What are the key properties of CID 134902405?
CID 134902405 has a molecular weight of 426.32 g/mol, XLogP of 3.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134902405 is sourced from PubChem (CID 134902405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).