4-chloro-2-methoxy-1-methylbenzene;ethane

C10H15ClO — CID 143462337

IUPAC4-chloro-2-methoxy-1-methylbenzene;ethane
SMILESCC.COc1cc(Cl)ccc1C
InChIInChI=1S/C8H9ClO.C2H6/c1-6-3-4-7(9)5-8(6)10-2;1-2/h3-5H,1-2H3;1-2H3
InChIKeyJJXJJHMCEAAXDD-UHFFFAOYSA-N
MW186.68 g/mol
LogP3.68
Rot. Bonds1

About 4-chloro-2-methoxy-1-methylbenzene;ethane

4-chloro-2-methoxy-1-methylbenzene;ethane (PubChem CID 143462337) has the molecular formula C10H15ClO and a molecular weight of 186.68 g/mol. Its IUPAC name is 4-chloro-2-methoxy-1-methylbenzene;ethane.

Molecular Properties

Compound Name4-chloro-2-methoxy-1-methylbenzene;ethane
PubChem CID143462337
Molecular FormulaC10H15ClO
Molecular Weight186.68 g/mol
Exact Mass186.08
IUPAC Name4-chloro-2-methoxy-1-methylbenzene;ethane
SMILESCC.COc1cc(Cl)ccc1C
InChIInChI=1S/C8H9ClO.C2H6/c1-6-3-4-7(9)5-8(6)10-2;1-2/h3-5H,1-2H3;1-2H3
InChIKeyJJXJJHMCEAAXDD-UHFFFAOYSA-N
XLogP3.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.68
LogP ≤ 53.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chlorophenyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 43481405
ethane;methane;3-methoxy-4-methylaniline
CID 144516222
CID 175597573
CID 175597573
1-(4-chloro-2-methoxyphenyl)-2-(3,4-dimethylphenyl)ethanone
CID 63527693
3-bromo-1-(4-chloro-2-methoxyphenyl)-2-fluoro-4-methylbenzene
CID 156561283
(3-methoxy-4-methylphenyl)azanium
CID 148795563
1-chloro-5-methoxy-2,4-dimethylbenzene;ethane
CID 144758840
(3-methoxy-4-methylphenyl)-oxoazanium
CID 143003126
2,4-dichloro-1-(4-chloro-2-methoxyphenyl)benzene
CID 70266325
1-[bromo-(4-chloro-2-methoxyphenyl)methyl]-4-methoxy-2-methylbenzene
CID 63438278
1-[bromo-(2,5-dimethylphenyl)methyl]-4-chloro-2-methoxybenzene
CID 55197809
ethane;1-methoxy-2,4,5-trimethylbenzene
CID 143418687

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-methoxy-1-methylbenzene;ethane?
The IUPAC name of 4-chloro-2-methoxy-1-methylbenzene;ethane (CID 143462337) is 4-chloro-2-methoxy-1-methylbenzene;ethane.
What is the SMILES notation for 4-chloro-2-methoxy-1-methylbenzene;ethane?
The canonical SMILES for 4-chloro-2-methoxy-1-methylbenzene;ethane is CC.COc1cc(Cl)ccc1C.
What is the InChIKey of 4-chloro-2-methoxy-1-methylbenzene;ethane?
The InChIKey is JJXJJHMCEAAXDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClO.C2H6/c1-6-3-4-7(9)5-8(6)10-2;1-2/h3-5H,1-2H3;1-2H3.
What are the key properties of 4-chloro-2-methoxy-1-methylbenzene;ethane?
4-chloro-2-methoxy-1-methylbenzene;ethane has a molecular weight of 186.68 g/mol, XLogP of 3.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methoxy-1-methylbenzene;ethane is sourced from PubChem (CID 143462337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).