[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol

C16H17ClO4 — CID 61268126

IUPAC[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol
SMILESCOc1ccc(CO)c(OCc2cc(Cl)ccc2OC)c1
InChIInChI=1S/C16H17ClO4/c1-19-14-5-3-11(9-18)16(8-14)21-10-12-7-13(17)4-6-15(12)20-2/h3-8,18H,9-10H2,1-2H3
InChIKeyRJDWWYQAJKMRRI-UHFFFAOYSA-N
MW308.76 g/mol
LogP3.43
Rot. Bonds6

About [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol

[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol (PubChem CID 61268126) has the molecular formula C16H17ClO4 and a molecular weight of 308.76 g/mol. Its IUPAC name is [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol.

Molecular Properties

Compound Name[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol
PubChem CID61268126
Molecular FormulaC16H17ClO4
Molecular Weight308.76 g/mol
Exact Mass308.08
IUPAC Name[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol
SMILESCOc1ccc(CO)c(OCc2cc(Cl)ccc2OC)c1
InChIInChI=1S/C16H17ClO4/c1-19-14-5-3-11(9-18)16(8-14)21-10-12-7-13(17)4-6-15(12)20-2/h3-8,18H,9-10H2,1-2H3
InChIKeyRJDWWYQAJKMRRI-UHFFFAOYSA-N
XLogP3.43
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.76
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-chloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
CID 43141927
[3,5-dichloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanol
CID 43646746
(2-ethoxy-4-methoxyphenyl)methanol
CID 61267380
1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 43424347
[2-[(3-bromo-2,6-difluorophenyl)methoxy]-4-methoxyphenyl]methanol
CID 106264385
4-chloro-2-[(3-chlorophenoxy)methyl]-1-methoxybenzene
CID 64764179
1-[5-chloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]-N-methylmethanamine
CID 43646631
(2-docosoxy-4-methoxyphenyl)methanol
CID 53257210
2-[(5-bromo-2-methylphenoxy)methyl]-4-chloro-1-methoxybenzene
CID 107284239
[2-[(2-chlorophenyl)methoxy]-5-methoxyphenyl]methanol
CID 43267981
(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol
CID 63365402
1-[2-[(2,4-dichlorophenyl)methoxy]-4-methoxyphenyl]ethanone
CID 78906437

Frequently Asked Questions

What is the IUPAC name of [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol?
The IUPAC name of [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol (CID 61268126) is [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol.
What is the SMILES notation for [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol?
The canonical SMILES for [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol is COc1ccc(CO)c(OCc2cc(Cl)ccc2OC)c1.
What is the InChIKey of [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol?
The InChIKey is RJDWWYQAJKMRRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO4/c1-19-14-5-3-11(9-18)16(8-14)21-10-12-7-13(17)4-6-15(12)20-2/h3-8,18H,9-10H2,1-2H3.
What are the key properties of [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol?
[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol has a molecular weight of 308.76 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol is sourced from PubChem (CID 61268126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).