carbanide;ethane;2-methoxybenzaldehyde;yttrium

C11H17O2Y- — CID 160914428

IUPACcarbanide;ethane;2-methoxybenzaldehyde;yttrium
SMILESCC.COc1ccccc1C=O.[CH3-].[Y]
InChIInChI=1S/C8H8O2.C2H6.CH3.Y/c1-10-8-5-3-2-4-7(8)6-9;1-2;;/h2-6H,1H3;1-2H3;1H3;/q;;-1;
InChIKeyHOJTXGIFOFERRJ-UHFFFAOYSA-N
MW270.16 g/mol
LogP2.98
Rot. Bonds2

About carbanide;ethane;2-methoxybenzaldehyde;yttrium

carbanide;ethane;2-methoxybenzaldehyde;yttrium (PubChem CID 160914428) has the molecular formula C11H17O2Y- and a molecular weight of 270.16 g/mol. Its IUPAC name is carbanide;ethane;2-methoxybenzaldehyde;yttrium.

Molecular Properties

Compound Namecarbanide;ethane;2-methoxybenzaldehyde;yttrium
PubChem CID160914428
Molecular FormulaC11H17O2Y-
Molecular Weight270.16 g/mol
Exact Mass270.03
IUPAC Namecarbanide;ethane;2-methoxybenzaldehyde;yttrium
SMILESCC.COc1ccccc1C=O.[CH3-].[Y]
InChIInChI=1S/C8H8O2.C2H6.CH3.Y/c1-10-8-5-3-2-4-7(8)6-9;1-2;;/h2-6H,1H3;1-2H3;1H3;/q;;-1;
InChIKeyHOJTXGIFOFERRJ-UHFFFAOYSA-N
XLogP2.98
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.16
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze carbanide;ethane;2-methoxybenzaldehyde;yttrium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-formyl-6-methoxyphenyl)-3-methoxybenzaldehyde
CID 15694387
2-methylperoxybenzaldehyde
CID 23505479
2-(2-formylphenoxy)-6-methoxybenzaldehyde
CID 102334226
2-methoxybenzaldehyde;2-oxabicyclo[2.1.0]pentane
CID 87135662
2-[4-(2-formylphenoxy)butoxy]benzaldehyde
CID 3090117
cyclopropane;2-methoxybenzaldehyde;2-oxabicyclo[2.2.2]octa-1(6),4,7-triene
CID 175295134
2-hydroxy-3-methoxybenzaldehyde
CID 8991
2-(2-methoxyphenyl)sulfanylbenzaldehyde
CID 12946428
2-[2-(2-methoxyphenyl)ethynyl]benzaldehyde
CID 25215814
2-hydroxy-3-methoxybenzaldehyde;methane
CID 165075137
(2E,3E)-2,3-bis[(2-methoxyphenyl)methylidene]butanedial
CID 87977206
copper;bis(2-hydroxy-3-methoxybenzaldehyde)
CID 50897387

Frequently Asked Questions

What is the IUPAC name of carbanide;ethane;2-methoxybenzaldehyde;yttrium?
The IUPAC name of carbanide;ethane;2-methoxybenzaldehyde;yttrium (CID 160914428) is carbanide;ethane;2-methoxybenzaldehyde;yttrium.
What is the SMILES notation for carbanide;ethane;2-methoxybenzaldehyde;yttrium?
The canonical SMILES for carbanide;ethane;2-methoxybenzaldehyde;yttrium is CC.COc1ccccc1C=O.[CH3-].[Y].
What is the InChIKey of carbanide;ethane;2-methoxybenzaldehyde;yttrium?
The InChIKey is HOJTXGIFOFERRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2.C2H6.CH3.Y/c1-10-8-5-3-2-4-7(8)6-9;1-2;;/h2-6H,1H3;1-2H3;1H3;/q;;-1;.
What are the key properties of carbanide;ethane;2-methoxybenzaldehyde;yttrium?
carbanide;ethane;2-methoxybenzaldehyde;yttrium has a molecular weight of 270.16 g/mol, XLogP of 2.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethane;2-methoxybenzaldehyde;yttrium is sourced from PubChem (CID 160914428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).