carbanide;3,5,7-trimethylundecane;yttrium

C15H32Y-2 — CID 58340673

IUPACcarbanide;3,5,7-trimethylundecane;yttrium
SMILES[CH2-]CCCC(C)CC(C)CC(C)CC.[CH3-].[Y]
InChIInChI=1S/C14H29.CH3.Y/c1-6-8-9-13(4)11-14(5)10-12(3)7-2;;/h12-14H,1,6-11H2,2-5H3;1H3;/q2*-1;
InChIKeyMRMNUOKWUAIFHS-UHFFFAOYSA-N
MW301.33 g/mol
LogP5.54
Rot. Bonds8

About carbanide;3,5,7-trimethylundecane;yttrium

carbanide;3,5,7-trimethylundecane;yttrium (PubChem CID 58340673) has the molecular formula C15H32Y-2 and a molecular weight of 301.33 g/mol. Its IUPAC name is carbanide;3,5,7-trimethylundecane;yttrium.

Molecular Properties

Compound Namecarbanide;3,5,7-trimethylundecane;yttrium
PubChem CID58340673
Molecular FormulaC15H32Y-2
Molecular Weight301.33 g/mol
Exact Mass301.16
IUPAC Namecarbanide;3,5,7-trimethylundecane;yttrium
SMILES[CH2-]CCCC(C)CC(C)CC(C)CC.[CH3-].[Y]
InChIInChI=1S/C14H29.CH3.Y/c1-6-8-9-13(4)11-14(5)10-12(3)7-2;;/h12-14H,1,6-11H2,2-5H3;1H3;/q2*-1;
InChIKeyMRMNUOKWUAIFHS-UHFFFAOYSA-N
XLogP5.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500301.33
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

Pristane
CID 15979
2-Methyldecane
CID 23415
Squalane
CID 8089
Phytane
CID 12523
2-Methyloctane
CID 18591
2-Methylundecane
CID 23459
Farnesane
CID 19773
4-Methyldecane
CID 17835
3-Methyldecane
CID 92239
2-Methylnonane
CID 13379
3,6-Dimethyloctane
CID 85927
2,6-Dimethyloctane
CID 16319

Frequently Asked Questions

What is the IUPAC name of carbanide;3,5,7-trimethylundecane;yttrium?
The IUPAC name of carbanide;3,5,7-trimethylundecane;yttrium (CID 58340673) is carbanide;3,5,7-trimethylundecane;yttrium.
What is the SMILES notation for carbanide;3,5,7-trimethylundecane;yttrium?
The canonical SMILES for carbanide;3,5,7-trimethylundecane;yttrium is [CH2-]CCCC(C)CC(C)CC(C)CC.[CH3-].[Y].
What is the InChIKey of carbanide;3,5,7-trimethylundecane;yttrium?
The InChIKey is MRMNUOKWUAIFHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29.CH3.Y/c1-6-8-9-13(4)11-14(5)10-12(3)7-2;;/h12-14H,1,6-11H2,2-5H3;1H3;/q2*-1;.
What are the key properties of carbanide;3,5,7-trimethylundecane;yttrium?
carbanide;3,5,7-trimethylundecane;yttrium has a molecular weight of 301.33 g/mol, XLogP of 5.54, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3,5,7-trimethylundecane;yttrium is sourced from PubChem (CID 58340673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).