CID 134981521

C10H15F3Ti — CID 134981521

IUPAC—
SMILESC[C]1C(C)=C(C)C(C)=C1C.F[Ti](F)F
InChIInChI=1S/C10H15.3FH.Ti/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;3*1H;/q;;;;+3/p-3
InChIKeyPGRWASLTIKJXNF-UHFFFAOYSA-K
MW240.09 g/mol
LogP4.53
Rot. Bonds

About CID 134981521

CID 134981521 (PubChem CID 134981521) has the molecular formula C10H15F3Ti and a molecular weight of 240.09 g/mol.

Molecular Properties

Compound NameCID 134981521
PubChem CID134981521
Molecular FormulaC10H15F3Ti
Molecular Weight240.09 g/mol
Exact Mass240.06
IUPAC Name—
SMILESC[C]1C(C)=C(C)C(C)=C1C.F[Ti](F)F
InChIInChI=1S/C10H15.3FH.Ti/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;3*1H;/q;;;;+3/p-3
InChIKeyPGRWASLTIKJXNF-UHFFFAOYSA-K
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.09
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 134981521?
The IUPAC name of CID 134981521 (CID 134981521) is not available.
What is the SMILES notation for CID 134981521?
The canonical SMILES for CID 134981521 is C[C]1C(C)=C(C)C(C)=C1C.F[Ti](F)F.
What is the InChIKey of CID 134981521?
The InChIKey is PGRWASLTIKJXNF-UHFFFAOYSA-K. The full InChI is InChI=1S/C10H15.3FH.Ti/c1-6-7(2)9(4)10(5)8(6)3;;;;/h1-5H3;3*1H;/q;;;;+3/p-3.
What are the key properties of CID 134981521?
CID 134981521 has a molecular weight of 240.09 g/mol, XLogP of 4.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134981521 is sourced from PubChem (CID 134981521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).