CID 134903033

C25H35Sm — CID 134903033

IUPAC—
SMILESC[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH]1[CH][CH][CH][CH]1.[Sm]
InChIInChI=1S/2C10H15.C5H5.Sm/c2*1-6-7(2)9(4)10(5)8(6)3;1-2-4-5-3-1;/h2*1-5H3;1-5H;
InChIKeyMTUYGTKRXDFUND-UHFFFAOYSA-N
MW485.92 g/mol
LogP6.97
Rot. Bonds

About CID 134903033

CID 134903033 (PubChem CID 134903033) has the molecular formula C25H35Sm and a molecular weight of 485.92 g/mol.

Molecular Properties

Compound NameCID 134903033
PubChem CID134903033
Molecular FormulaC25H35Sm
Molecular Weight485.92 g/mol
Exact Mass487.19
IUPAC Name—
SMILESC[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH]1[CH][CH][CH][CH]1.[Sm]
InChIInChI=1S/2C10H15.C5H5.Sm/c2*1-6-7(2)9(4)10(5)8(6)3;1-2-4-5-3-1;/h2*1-5H3;1-5H;
InChIKeyMTUYGTKRXDFUND-UHFFFAOYSA-N
XLogP6.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.92
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 134903033?
The IUPAC name of CID 134903033 (CID 134903033) is not available.
What is the SMILES notation for CID 134903033?
The canonical SMILES for CID 134903033 is C[C]1[C](C)[C](C)[C](C)[C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[CH]1[CH][CH][CH][CH]1.[Sm].
What is the InChIKey of CID 134903033?
The InChIKey is MTUYGTKRXDFUND-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H15.C5H5.Sm/c2*1-6-7(2)9(4)10(5)8(6)3;1-2-4-5-3-1;/h2*1-5H3;1-5H;.
What are the key properties of CID 134903033?
CID 134903033 has a molecular weight of 485.92 g/mol, XLogP of 6.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134903033 is sourced from PubChem (CID 134903033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).