2,5-bis[(2-chlorophenyl)methoxy]phenol

C20H16Cl2O3 — CID 139941911

IUPAC2,5-bis[(2-chlorophenyl)methoxy]phenol
SMILESOc1cc(OCc2ccccc2Cl)ccc1OCc1ccccc1Cl
InChIInChI=1S/C20H16Cl2O3/c21-17-7-3-1-5-14(17)12-24-16-9-10-20(19(23)11-16)25-13-15-6-2-4-8-18(15)22/h1-11,23H,12-13H2
InChIKeyCDHHAVWUAVJWNB-UHFFFAOYSA-N
MW375.25 g/mol
LogP5.86
Rot. Bonds6

About 2,5-bis[(2-chlorophenyl)methoxy]phenol

2,5-bis[(2-chlorophenyl)methoxy]phenol (PubChem CID 139941911) has the molecular formula C20H16Cl2O3 and a molecular weight of 375.25 g/mol. Its IUPAC name is 2,5-bis[(2-chlorophenyl)methoxy]phenol.

Molecular Properties

Compound Name2,5-bis[(2-chlorophenyl)methoxy]phenol
PubChem CID139941911
Molecular FormulaC20H16Cl2O3
Molecular Weight375.25 g/mol
Exact Mass374.05
IUPAC Name2,5-bis[(2-chlorophenyl)methoxy]phenol
SMILESOc1cc(OCc2ccccc2Cl)ccc1OCc1ccccc1Cl
InChIInChI=1S/C20H16Cl2O3/c21-17-7-3-1-5-14(17)12-24-16-9-10-20(19(23)11-16)25-13-15-6-2-4-8-18(15)22/h1-11,23H,12-13H2
InChIKeyCDHHAVWUAVJWNB-UHFFFAOYSA-N
XLogP5.86
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.25
LogP ≤ 55.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,2,4-tris[(2-chlorophenyl)methoxy]benzene
CID 139941968
1,4-bis[(2-chlorophenyl)methoxy]benzene
CID 18515510
1-[4-[(2-chlorophenyl)methoxy]-3-hydroxyphenyl]ethanone
CID 10850109
4-[(2-chlorophenyl)methoxy]-2-hydroxybenzoic acid
CID 91679064
[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methanol
CID 43267981
2,5-bis[(3-chlorophenyl)methoxy]phenol
CID 139941886
2-(chloromethyl)-1-[(2-chlorophenyl)methoxy]-4-methoxybenzene
CID 43268073
3-[(2-chlorophenyl)methoxy]aniline
CID 23010255
N-[[3-[(2-chlorophenyl)methoxy]phenyl]methylidene]hydroxylamine
CID 20987989
4-[(2-chlorophenyl)methoxy]-2-ethoxyaniline
CID 63676329
N-[[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]ethanamine
CID 60878145
1-chloro-2-[[3-(chloromethyl)phenoxy]methyl]benzene
CID 29299545

Frequently Asked Questions

What is the IUPAC name of 2,5-bis[(2-chlorophenyl)methoxy]phenol?
The IUPAC name of 2,5-bis[(2-chlorophenyl)methoxy]phenol (CID 139941911) is 2,5-bis[(2-chlorophenyl)methoxy]phenol.
What is the SMILES notation for 2,5-bis[(2-chlorophenyl)methoxy]phenol?
The canonical SMILES for 2,5-bis[(2-chlorophenyl)methoxy]phenol is Oc1cc(OCc2ccccc2Cl)ccc1OCc1ccccc1Cl.
What is the InChIKey of 2,5-bis[(2-chlorophenyl)methoxy]phenol?
The InChIKey is CDHHAVWUAVJWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16Cl2O3/c21-17-7-3-1-5-14(17)12-24-16-9-10-20(19(23)11-16)25-13-15-6-2-4-8-18(15)22/h1-11,23H,12-13H2.
What are the key properties of 2,5-bis[(2-chlorophenyl)methoxy]phenol?
2,5-bis[(2-chlorophenyl)methoxy]phenol has a molecular weight of 375.25 g/mol, XLogP of 5.86, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-bis[(2-chlorophenyl)methoxy]phenol is sourced from PubChem (CID 139941911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).