carbanide;ethane;prop-1-enylbenzene;yttrium

C14H24Y-2 — CID 162283709

IUPACcarbanide;ethane;prop-1-enylbenzene;yttrium
SMILESCC.CC.[CH2-]C=Cc1ccccc1.[CH3-].[Y]
InChIInChI=1S/C9H9.2C2H6.CH3.Y/c1-2-6-9-7-4-3-5-8-9;2*1-2;;/h2-8H,1H2;2*1-2H3;1H3;/q-1;;;-1;
InChIKeyRTMKOYIJQKYEBM-UHFFFAOYSA-N
MW281.25 g/mol
LogP5.03
Rot. Bonds1

About carbanide;ethane;prop-1-enylbenzene;yttrium

carbanide;ethane;prop-1-enylbenzene;yttrium (PubChem CID 162283709) has the molecular formula C14H24Y-2 and a molecular weight of 281.25 g/mol. Its IUPAC name is carbanide;ethane;prop-1-enylbenzene;yttrium.

Molecular Properties

Compound Namecarbanide;ethane;prop-1-enylbenzene;yttrium
PubChem CID162283709
Molecular FormulaC14H24Y-2
Molecular Weight281.25 g/mol
Exact Mass281.09
IUPAC Namecarbanide;ethane;prop-1-enylbenzene;yttrium
SMILESCC.CC.[CH2-]C=Cc1ccccc1.[CH3-].[Y]
InChIInChI=1S/C9H9.2C2H6.CH3.Y/c1-2-6-9-7-4-3-5-8-9;2*1-2;;/h2-8H,1H2;2*1-2H3;1H3;/q-1;;;-1;
InChIKeyRTMKOYIJQKYEBM-UHFFFAOYSA-N
XLogP5.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500281.25
LogP ≤ 55.03
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

1,4-bis(2-phenylethenyl)benzene;carbanide;ethane;ethane;methane;tetrakis(yttrium)
CID 159183097
ethane;[(Z)-prop-1-enyl]benzene
CID 90831801
carbanide;ethane;methane;1-(2-phenylethenyl)-4-[4-(2-phenylethenyl)phenyl]benzene;propane;yttrium
CID 159447885
CID 70567885
CID 70567885
CID 70569152
CID 70569152
N,N-dimethylmethanamine;stilbene
CID 174368184
4-phenylbuta-1,3-dienylbenzene
CID 162273071
[(1Z,3Z)-4-phenylbuta-1,3-dienyl]benzene
CID 139179602
hydride;rubidium(1+);stilbene
CID 173437843
disodium;hydride;(E)-stilbene
CID 173089328
CID 157355117
CID 157355117
trimethyl-[(E)-2-phenylethenyl]azanium chloride
CID 87786128

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;prop-1-enylbenzene;yttrium?
The IUPAC name of carbanide;ethane;prop-1-enylbenzene;yttrium (CID 162283709) is carbanide;ethane;prop-1-enylbenzene;yttrium.
What is the SMILES notation for carbanide;ethane;prop-1-enylbenzene;yttrium?
The canonical SMILES for carbanide;ethane;prop-1-enylbenzene;yttrium is CC.CC.[CH2-]C=Cc1ccccc1.[CH3-].[Y].
What is the InChIKey of carbanide;ethane;prop-1-enylbenzene;yttrium?
The InChIKey is RTMKOYIJQKYEBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9.2C2H6.CH3.Y/c1-2-6-9-7-4-3-5-8-9;2*1-2;;/h2-8H,1H2;2*1-2H3;1H3;/q-1;;;-1;.
What are the key properties of carbanide;ethane;prop-1-enylbenzene;yttrium?
carbanide;ethane;prop-1-enylbenzene;yttrium has a molecular weight of 281.25 g/mol, XLogP of 5.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;prop-1-enylbenzene;yttrium is sourced from PubChem (CID 162283709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).