carbanide;ethyne;prop-1-yne;yttrium(3+)

C6H7Y — CID 20801486

IUPACcarbanide;ethyne;prop-1-yne;yttrium(3+)
SMILES[C-]#C.[C-]#CC.[CH3-].[Y+3]
InChIInChI=1S/C3H3.C2H.CH3.Y/c1-3-2;1-2;;/h1H3;1H;1H3;/q3*-1;+3
InChIKeyUQPCMTIYDUNRTL-UHFFFAOYSA-N
MW168.03 g/mol
LogP1.25
Rot. Bonds

About carbanide;ethyne;prop-1-yne;yttrium(3+)

carbanide;ethyne;prop-1-yne;yttrium(3+) (PubChem CID 20801486) has the molecular formula C6H7Y and a molecular weight of 168.03 g/mol. Its IUPAC name is carbanide;ethyne;prop-1-yne;yttrium(3+).

Molecular Properties

Compound Namecarbanide;ethyne;prop-1-yne;yttrium(3+)
PubChem CID20801486
Molecular FormulaC6H7Y
Molecular Weight168.03 g/mol
Exact Mass167.96
IUPAC Namecarbanide;ethyne;prop-1-yne;yttrium(3+)
SMILES[C-]#C.[C-]#CC.[CH3-].[Y+3]
InChIInChI=1S/C3H3.C2H.CH3.Y/c1-3-2;1-2;;/h1H3;1H;1H3;/q3*-1;+3
InChIKeyUQPCMTIYDUNRTL-UHFFFAOYSA-N
XLogP1.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.03
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;ethyne;prop-1-yne;yttrium(3+)?
The IUPAC name of carbanide;ethyne;prop-1-yne;yttrium(3+) (CID 20801486) is carbanide;ethyne;prop-1-yne;yttrium(3+).
What is the SMILES notation for carbanide;ethyne;prop-1-yne;yttrium(3+)?
The canonical SMILES for carbanide;ethyne;prop-1-yne;yttrium(3+) is [C-]#C.[C-]#CC.[CH3-].[Y+3].
What is the InChIKey of carbanide;ethyne;prop-1-yne;yttrium(3+)?
The InChIKey is UQPCMTIYDUNRTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3.C2H.CH3.Y/c1-3-2;1-2;;/h1H3;1H;1H3;/q3*-1;+3.
What are the key properties of carbanide;ethyne;prop-1-yne;yttrium(3+)?
carbanide;ethyne;prop-1-yne;yttrium(3+) has a molecular weight of 168.03 g/mol, XLogP of 1.25, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethyne;prop-1-yne;yttrium(3+) is sourced from PubChem (CID 20801486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).