1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one

C16H15ClO2 — CID 29287743

IUPAC1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one
SMILESCCC(=O)c1ccccc1OCc1ccccc1Cl
InChIInChI=1S/C16H15ClO2/c1-2-15(18)13-8-4-6-10-16(13)19-11-12-7-3-5-9-14(12)17/h3-10H,2,11H2,1H3
InChIKeyVGGQZJLWZSRWLT-UHFFFAOYSA-N
MW274.75 g/mol
LogP4.51
Rot. Bonds5

About 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one

1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one (PubChem CID 29287743) has the molecular formula C16H15ClO2 and a molecular weight of 274.75 g/mol. Its IUPAC name is 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one.

Molecular Properties

Compound Name1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one
PubChem CID29287743
Molecular FormulaC16H15ClO2
Molecular Weight274.75 g/mol
Exact Mass274.08
IUPAC Name1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one
SMILESCCC(=O)c1ccccc1OCc1ccccc1Cl
InChIInChI=1S/C16H15ClO2/c1-2-15(18)13-8-4-6-10-16(13)19-11-12-7-3-5-9-14(12)17/h3-10H,2,11H2,1H3
InChIKeyVGGQZJLWZSRWLT-UHFFFAOYSA-N
XLogP4.51
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methoxy]-N,N-diethylbenzamide
CID 13073609
1-[2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]propan-1-one
CID 103046633
(2-methoxyphenyl) 2-[(2-chlorophenyl)methoxy]benzoate
CID 2392110
(2-methylphenyl) 2-[(2-chlorophenyl)methoxy]benzoate
CID 2457678
ethane;1-(2-ethoxyphenyl)propan-1-one
CID 145111899
1-[2,3-bis[(2-chlorophenyl)methoxy]phenyl]propane-1,2-dione
CID 23590494
2-[(2-chlorophenyl)methoxy]-N'-(2-fluorobenzoyl)benzohydrazide
CID 26901785
1-[2-(2,3-dichlorophenoxy)phenyl]propan-1-one
CID 112677577
1-[2-(methoxymethoxy)phenyl]propan-1-one
CID 15053855
[2-(4-fluorophenyl)-2-oxoethyl] 2-[(2-chlorophenyl)methoxy]benzoate
CID 23904435
[2-[(2-chlorophenyl)methoxy]phenyl]-piperazin-1-ylmethanone
CID 83475674
1-[2-[[2-[(2-acetylphenoxy)methyl]phenyl]methoxy]phenyl]ethanone
CID 13256788

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one?
The IUPAC name of 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one (CID 29287743) is 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one.
What is the SMILES notation for 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one?
The canonical SMILES for 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one is CCC(=O)c1ccccc1OCc1ccccc1Cl.
What is the InChIKey of 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one?
The InChIKey is VGGQZJLWZSRWLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClO2/c1-2-15(18)13-8-4-6-10-16(13)19-11-12-7-3-5-9-14(12)17/h3-10H,2,11H2,1H3.
What are the key properties of 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one?
1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one has a molecular weight of 274.75 g/mol, XLogP of 4.51, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(2-chlorophenyl)methoxy]phenyl]propan-1-one is sourced from PubChem (CID 29287743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).