1-chloro-2-methylbenzene-5-ide;yttrium

C7H6ClY- — CID 59141126

IUPAC1-chloro-2-methylbenzene-5-ide;yttrium
SMILESCc1cc[c-]cc1Cl.[Y]
InChIInChI=1S/C7H6Cl.Y/c1-6-4-2-3-5-7(6)8;/h2,4-5H,1H3;/q-1;
InChIKeyWAXWSETVZJXDJX-UHFFFAOYSA-N
MW214.48 g/mol
LogP2.45
Rot. Bonds

About 1-chloro-2-methylbenzene-5-ide;yttrium

1-chloro-2-methylbenzene-5-ide;yttrium (PubChem CID 59141126) has the molecular formula C7H6ClY- and a molecular weight of 214.48 g/mol. Its IUPAC name is 1-chloro-2-methylbenzene-5-ide;yttrium.

Molecular Properties

Compound Name1-chloro-2-methylbenzene-5-ide;yttrium
PubChem CID59141126
Molecular FormulaC7H6ClY-
Molecular Weight214.48 g/mol
Exact Mass213.92
IUPAC Name1-chloro-2-methylbenzene-5-ide;yttrium
SMILESCc1cc[c-]cc1Cl.[Y]
InChIInChI=1S/C7H6Cl.Y/c1-6-4-2-3-5-7(6)8;/h2,4-5H,1H3;/q-1;
InChIKeyWAXWSETVZJXDJX-UHFFFAOYSA-N
XLogP2.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.48
LogP ≤ 52.45
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

bis(2-methylbenzene-4-id-1-amine);yttrium
CID 58340340
azanide;2-methylbenzene-5-id-1-amine;tetrachloroplatinum
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6,7-dimethyl-2H-naphthalen-2-ide;bis(yttrium)
CID 58729657
lithium 1-methyl-2-(trifluoromethyl)benzene-4-ide
CID 87932261
1,2-dimethylbenzene-5-ide;1,2-dimethylbenzene-6-ide;yttrium
CID 154612836
acetylazanide;2-methylbenzene-5-ide-1-sulfonamide;yttrium
CID 59870138
4-methyl-6H-quinolin-6-ide;yttrium
CID 59098038
2-(2-methylbenzene-4-id-1-yl)acetic acid;yttrium
CID 58913104
carbanide;1-(2-methylbenzene-4-id-1-yl)ethanone;yttrium
CID 58533651
methylbenzene;2-methylbenzene-5-ide-1-sulfonic acid;yttrium
CID 58427650
methane;methylbenzene;yttrium
CID 160876865
ethane;methylbenzene;yttrium
CID 158556230

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-methylbenzene-5-ide;yttrium?
The IUPAC name of 1-chloro-2-methylbenzene-5-ide;yttrium (CID 59141126) is 1-chloro-2-methylbenzene-5-ide;yttrium.
What is the SMILES notation for 1-chloro-2-methylbenzene-5-ide;yttrium?
The canonical SMILES for 1-chloro-2-methylbenzene-5-ide;yttrium is Cc1cc[c-]cc1Cl.[Y].
What is the InChIKey of 1-chloro-2-methylbenzene-5-ide;yttrium?
The InChIKey is WAXWSETVZJXDJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6Cl.Y/c1-6-4-2-3-5-7(6)8;/h2,4-5H,1H3;/q-1;.
What are the key properties of 1-chloro-2-methylbenzene-5-ide;yttrium?
1-chloro-2-methylbenzene-5-ide;yttrium has a molecular weight of 214.48 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-methylbenzene-5-ide;yttrium is sourced from PubChem (CID 59141126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).