1-methyl-2-propan-2-yloxybenzene;trichlororuthenium

C10H14Cl3ORu — CID 175208112

IUPAC1-methyl-2-propan-2-yloxybenzene;trichlororuthenium
SMILESCc1ccccc1OC(C)C.Cl[Ru](Cl)Cl
InChIInChI=1S/C10H14O.3ClH.Ru/c1-8(2)11-10-7-5-4-6-9(10)3;;;;/h4-8H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyIUOWRMPRGJXBSB-UHFFFAOYSA-K
MW357.65 g/mol
LogP4.85
Rot. Bonds2

About 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium

1-methyl-2-propan-2-yloxybenzene;trichlororuthenium (PubChem CID 175208112) has the molecular formula C10H14Cl3ORu and a molecular weight of 357.65 g/mol. Its IUPAC name is 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium.

Molecular Properties

Compound Name1-methyl-2-propan-2-yloxybenzene;trichlororuthenium
PubChem CID175208112
Molecular FormulaC10H14Cl3ORu
Molecular Weight357.65 g/mol
Exact Mass356.92
IUPAC Name1-methyl-2-propan-2-yloxybenzene;trichlororuthenium
SMILESCc1ccccc1OC(C)C.Cl[Ru](Cl)Cl
InChIInChI=1S/C10H14O.3ClH.Ru/c1-8(2)11-10-7-5-4-6-9(10)3;;;;/h4-8H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyIUOWRMPRGJXBSB-UHFFFAOYSA-K
XLogP4.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.65
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(1-iodoethoxy)-2-methylbenzene
CID 135136268
1-chloro-2-propan-2-yloxybenzene;ethane
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2-(2-methylphenoxy)propylhydrazine
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1-methyl-2-[(E,2R)-pent-3-en-2-yl]oxybenzene
CID 125475972
1,3-bis(2,4,6-trimethylphenyl)imidazolidine;1-methyl-2-propan-2-yloxybenzene;ruthenium(2+);dichloride
CID 24810515
(2-chloro-3-methylphenyl)-(2-propan-2-yloxyphenyl)methanamine
CID 105018279
CID 174286143
CID 174286143
(2S)-2-(2-methylphenoxy)propanoate
CID 6957172
4-(2-methylphenoxy)pentan-2-amine
CID 64707496
2,2-bis(2-methylphenoxy)ethylphosphane
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4-fluoro-2-methyl-1-propan-2-yloxybenzene
CID 58970665

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium?
The IUPAC name of 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium (CID 175208112) is 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium.
What is the SMILES notation for 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium?
The canonical SMILES for 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium is Cc1ccccc1OC(C)C.Cl[Ru](Cl)Cl.
What is the InChIKey of 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium?
The InChIKey is IUOWRMPRGJXBSB-UHFFFAOYSA-K. The full InChI is InChI=1S/C10H14O.3ClH.Ru/c1-8(2)11-10-7-5-4-6-9(10)3;;;;/h4-8H,1-3H3;3*1H;/q;;;;+3/p-3.
What are the key properties of 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium?
1-methyl-2-propan-2-yloxybenzene;trichlororuthenium has a molecular weight of 357.65 g/mol, XLogP of 4.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-propan-2-yloxybenzene;trichlororuthenium is sourced from PubChem (CID 175208112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).