CID 10106540

C10H10BrTi+3 — CID 10106540

IUPAC—
SMILES[Br-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+4]
InChIInChI=1S/2C5H5.BrH.Ti/c2*1-2-4-5-3-1;;/h2*1-5H;1H;/q;;;+4/p-1
InChIKeySJHUFPRXNLLIQP-UHFFFAOYSA-M
MW257.96 g/mol
LogP-0.96
Rot. Bonds

About CID 10106540

CID 10106540 (PubChem CID 10106540) has the molecular formula C10H10BrTi+3 and a molecular weight of 257.96 g/mol.

Molecular Properties

Compound NameCID 10106540
PubChem CID10106540
Molecular FormulaC10H10BrTi+3
Molecular Weight257.96 g/mol
Exact Mass256.94
IUPAC Name—
SMILES[Br-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+4]
InChIInChI=1S/2C5H5.BrH.Ti/c2*1-2-4-5-3-1;;/h2*1-5H;1H;/q;;;+4/p-1
InChIKeySJHUFPRXNLLIQP-UHFFFAOYSA-M
XLogP-0.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.96
LogP ≤ 5-0.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 10106540?
The IUPAC name of CID 10106540 (CID 10106540) is not available.
What is the SMILES notation for CID 10106540?
The canonical SMILES for CID 10106540 is [Br-].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Ti+4].
What is the InChIKey of CID 10106540?
The InChIKey is SJHUFPRXNLLIQP-UHFFFAOYSA-M. The full InChI is InChI=1S/2C5H5.BrH.Ti/c2*1-2-4-5-3-1;;/h2*1-5H;1H;/q;;;+4/p-1.
What are the key properties of CID 10106540?
CID 10106540 has a molecular weight of 257.96 g/mol, XLogP of -0.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10106540 is sourced from PubChem (CID 10106540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).