1-(4-methoxyphenyl)ethanone;hydrochloride

C9H11ClO2 — CID 23164565

IUPAC1-(4-methoxyphenyl)ethanone;hydrochloride
SMILESCOc1ccc(C(C)=O)cc1.Cl
InChIInChI=1S/C9H10O2.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-6H,1-2H3;1H
InChIKeyKSYXYMNODSUDGV-UHFFFAOYSA-N
MW186.64 g/mol
LogP2.32
Rot. Bonds2

About 1-(4-methoxyphenyl)ethanone;hydrochloride

1-(4-methoxyphenyl)ethanone;hydrochloride (PubChem CID 23164565) has the molecular formula C9H11ClO2 and a molecular weight of 186.64 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)ethanone;hydrochloride.

Molecular Properties

Compound Name1-(4-methoxyphenyl)ethanone;hydrochloride
PubChem CID23164565
Molecular FormulaC9H11ClO2
Molecular Weight186.64 g/mol
Exact Mass186.04
IUPAC Name1-(4-methoxyphenyl)ethanone;hydrochloride
SMILESCOc1ccc(C(C)=O)cc1.Cl
InChIInChI=1S/C9H10O2.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-6H,1-2H3;1H
InChIKeyKSYXYMNODSUDGV-UHFFFAOYSA-N
XLogP2.32
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.64
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-methoxyphenyl)ethanone;hydrochloride 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

1-(3-acetylphenyl)ethanone;1-methoxy-4-(4-methoxyphenyl)benzene;1-(4-methoxyphenyl)ethanone
CID 161177780
1-[4-(6-methoxynaphthalen-2-yl)phenyl]ethanone;1-(4-methoxyphenyl)ethanone
CID 91415101
N-(4-acetylphenyl)-N-(4-methoxyphenyl)nitrous amide
CID 11288691
(4-methoxyphenyl)-(4-methylphenyl)methanone;1-[4-[4-(4-methylphenoxy)benzoyl]phenyl]ethanone
CID 145054271
1-(4-methoxyphenyl)ethanone;2-(4-methoxyphenyl)propanoic acid
CID 157331478
1-(4-acetylphenyl)-3-(4-methoxyphenoxy)propan-1-one
CID 163833634
[4-[4-[4-(4-methoxybenzoyl)phenoxy]benzoyl]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzoyl]phenoxy]phenyl]ethanone;1-[4-[4-[4-[4-[4-(4-methylphenyl)phenoxy]phenoxy]benzoyl]phenoxy]phenyl]ethanone;1-[4-[4-[4-[4-[4-(4-methylphenyl)phenoxy]phenoxy]benzoyl]phenyl]phenyl]ethanone
CID 158374432
1-[4-[4-[(4-methoxyphenyl)methoxy]phenyl]phenyl]ethanone
CID 14597431
(7-methoxynaphthalen-2-yl) 4-acetylbenzoate
CID 58800516
[4-[4-[4-(4-methoxybenzoyl)benzoyl]phenoxy]phenyl]-(4-methylphenyl)methanone;(4-methoxyphenyl)-[4-(4-methylphenoxy)phenyl]methanone;(4-methoxyphenyl)-(4-methylphenyl)methanone;(4-methoxyphenyl)-[4-[4-(4-methylphenyl)phenoxy]phenyl]methanone;1-[4-[4-[4-[4-(4-methylphenoxy)benzoyl]phenoxy]benzoyl]phenyl]ethanone;1-[4-[4-[4-[4-(4-methylphenoxy)phenoxy]benzoyl]phenoxy]phenyl]ethanone;1-[4-[4-[4-[4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzoyl]phenoxy]phenoxy]phenyl]ethanone;1-[4-[4-[4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzoyl]phenoxy]phenyl]ethanone;1-[4-[4-[4-[4-[4-(4-methylphenyl)phenoxy]phenoxy]benzoyl]phenoxy]phenyl]ethanone
CID 158259629
(4-methoxybenzoyl)-λ2-stannane
CID 174742034
1-(4-sulfanyloxyphenyl)ethanone
CID 87171019

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)ethanone;hydrochloride?
The IUPAC name of 1-(4-methoxyphenyl)ethanone;hydrochloride (CID 23164565) is 1-(4-methoxyphenyl)ethanone;hydrochloride.
What is the SMILES notation for 1-(4-methoxyphenyl)ethanone;hydrochloride?
The canonical SMILES for 1-(4-methoxyphenyl)ethanone;hydrochloride is COc1ccc(C(C)=O)cc1.Cl.
What is the InChIKey of 1-(4-methoxyphenyl)ethanone;hydrochloride?
The InChIKey is KSYXYMNODSUDGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2.ClH/c1-7(10)8-3-5-9(11-2)6-4-8;/h3-6H,1-2H3;1H.
What are the key properties of 1-(4-methoxyphenyl)ethanone;hydrochloride?
1-(4-methoxyphenyl)ethanone;hydrochloride has a molecular weight of 186.64 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)ethanone;hydrochloride is sourced from PubChem (CID 23164565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).