[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol

C15H14Cl2O3 — CID 43516151

IUPAC[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
SMILESCOc1ccc(COc2c(Cl)cc(Cl)cc2CO)cc1
InChIInChI=1S/C15H14Cl2O3/c1-19-13-4-2-10(3-5-13)9-20-15-11(8-18)6-12(16)7-14(15)17/h2-7,18H,8-9H2,1H3
InChIKeyDEQPOPSPHQBNMH-UHFFFAOYSA-N
MW313.18 g/mol
LogP4.07
Rot. Bonds5

About [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol

[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol (PubChem CID 43516151) has the molecular formula C15H14Cl2O3 and a molecular weight of 313.18 g/mol. Its IUPAC name is [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
PubChem CID43516151
Molecular FormulaC15H14Cl2O3
Molecular Weight313.18 g/mol
Exact Mass312.03
IUPAC Name[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
SMILESCOc1ccc(COc2c(Cl)cc(Cl)cc2CO)cc1
InChIInChI=1S/C15H14Cl2O3/c1-19-13-4-2-10(3-5-13)9-20-15-11(8-18)6-12(16)7-14(15)17/h2-7,18H,8-9H2,1H3
InChIKeyDEQPOPSPHQBNMH-UHFFFAOYSA-N
XLogP4.07
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.18
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2-bromo-5-methoxyphenyl)methoxy]-3,5-dichlorophenyl]methanol
CID 65322928
[5-chloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
CID 43141927
[3,5-dichloro-2-[(4-methoxy-6-methyl-2-pyridinyl)methoxy]phenyl]methanol
CID 82886627
[3,5-dichloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanol
CID 43646746
[3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046936
1,5-dichloro-2-[[4-[(2,4-dichloro-6-prop-2-enylphenoxy)methyl]phenyl]methoxy]-3-prop-2-enylbenzene
CID 59551589
1-(bromomethyl)-3,5-dichloro-2-[(4-ethylphenyl)methoxy]benzene
CID 63535878
[3-bromo-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
CID 61391527
1-chloro-5-(chloromethyl)-3-methoxy-2-[(4-methoxyphenyl)methoxy]benzene
CID 28898530
[2-[(3,4-difluorophenyl)methoxy]-3-(hydroxymethyl)-5-methoxyphenyl]methanol
CID 75519404
1-(bromomethyl)-3-chloro-2-[(4-methoxyphenyl)methoxy]benzene
CID 112613844
[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol
CID 62196694

Frequently Asked Questions

What is the IUPAC name of [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol?
The IUPAC name of [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol (CID 43516151) is [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol?
The canonical SMILES for [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol is COc1ccc(COc2c(Cl)cc(Cl)cc2CO)cc1.
What is the InChIKey of [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol?
The InChIKey is DEQPOPSPHQBNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O3/c1-19-13-4-2-10(3-5-13)9-20-15-11(8-18)6-12(16)7-14(15)17/h2-7,18H,8-9H2,1H3.
What are the key properties of [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol?
[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol has a molecular weight of 313.18 g/mol, XLogP of 4.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 43516151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).