2-chloro-6-methylphenol;yttrium

C7H7ClOY — CID 178141464

IUPAC2-chloro-6-methylphenol;yttrium
SMILESCc1cccc(Cl)c1O.[Y]
InChIInChI=1S/C7H7ClO.Y/c1-5-3-2-4-6(8)7(5)9;/h2-4,9H,1H3;
InChIKeyAWJRQKNHKOERCK-UHFFFAOYSA-N
MW231.49 g/mol
LogP2.35
Rot. Bonds

About 2-chloro-6-methylphenol;yttrium

2-chloro-6-methylphenol;yttrium (PubChem CID 178141464) has the molecular formula C7H7ClOY and a molecular weight of 231.49 g/mol. Its IUPAC name is 2-chloro-6-methylphenol;yttrium.

Molecular Properties

Compound Name2-chloro-6-methylphenol;yttrium
PubChem CID178141464
Molecular FormulaC7H7ClOY
Molecular Weight231.49 g/mol
Exact Mass230.92
IUPAC Name2-chloro-6-methylphenol;yttrium
SMILESCc1cccc(Cl)c1O.[Y]
InChIInChI=1S/C7H7ClO.Y/c1-5-3-2-4-6(8)7(5)9;/h2-4,9H,1H3;
InChIKeyAWJRQKNHKOERCK-UHFFFAOYSA-N
XLogP2.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.49
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 66838097
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1-chloro-2-methylbenzene;dihydrochloride
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2-chloro-3-methylphenol;ethane
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butane;2,6-dimethylphenol;ethane
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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methylphenol;yttrium?
The IUPAC name of 2-chloro-6-methylphenol;yttrium (CID 178141464) is 2-chloro-6-methylphenol;yttrium.
What is the SMILES notation for 2-chloro-6-methylphenol;yttrium?
The canonical SMILES for 2-chloro-6-methylphenol;yttrium is Cc1cccc(Cl)c1O.[Y].
What is the InChIKey of 2-chloro-6-methylphenol;yttrium?
The InChIKey is AWJRQKNHKOERCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClO.Y/c1-5-3-2-4-6(8)7(5)9;/h2-4,9H,1H3;.
What are the key properties of 2-chloro-6-methylphenol;yttrium?
2-chloro-6-methylphenol;yttrium has a molecular weight of 231.49 g/mol, XLogP of 2.35, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methylphenol;yttrium is sourced from PubChem (CID 178141464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).