[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol

C16H17ClO3 — CID 4736676

IUPAC[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol
SMILESCCOc1cccc(CO)c1OCc1ccccc1Cl
InChIInChI=1S/C16H17ClO3/c1-2-19-15-9-5-7-12(10-18)16(15)20-11-13-6-3-4-8-14(13)17/h3-9,18H,2,10-11H2,1H3
InChIKeySXARRLZDPRKNMN-UHFFFAOYSA-N
MW292.76 g/mol
LogP3.81
Rot. Bonds6

About [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol

[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol (PubChem CID 4736676) has the molecular formula C16H17ClO3 and a molecular weight of 292.76 g/mol. Its IUPAC name is [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol.

Molecular Properties

Compound Name[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol
PubChem CID4736676
Molecular FormulaC16H17ClO3
Molecular Weight292.76 g/mol
Exact Mass292.09
IUPAC Name[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol
SMILESCCOc1cccc(CO)c1OCc1ccccc1Cl
InChIInChI=1S/C16H17ClO3/c1-2-19-15-9-5-7-12(10-18)16(15)20-11-13-6-3-4-8-14(13)17/h3-9,18H,2,10-11H2,1H3
InChIKeySXARRLZDPRKNMN-UHFFFAOYSA-N
XLogP3.81
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.76
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2,3-bis[(2-chlorophenyl)methoxy]phenyl]methanol
CID 23590539
2-[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]ethanamine
CID 60905689
1-[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]-N-[(2-chlorophenyl)methyl]methanamine;hydrochloride
CID 17206090
[2-[(5-chloro-2-fluorophenyl)methoxy]-3-ethoxyphenyl]methanol
CID 103046926
N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]propan-1-amine
CID 17206158
N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]propan-1-amine;hydrochloride
CID 17206157
[3-chloro-2-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 112612839
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[3-ethoxy-2-(methoxymethoxy)phenyl]methanol
CID 65364783
N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]-N',N'-diethylethane-1,2-diamine
CID 17216180
N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]-3-ethoxypropan-1-amine;hydrochloride
CID 17206139
N-[[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]-N',N'-diethylethane-1,2-diamine;dihydrochloride
CID 17216179

Frequently Asked Questions

What is the IUPAC name of [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol?
The IUPAC name of [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol (CID 4736676) is [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol.
What is the SMILES notation for [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol?
The canonical SMILES for [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol is CCOc1cccc(CO)c1OCc1ccccc1Cl.
What is the InChIKey of [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol?
The InChIKey is SXARRLZDPRKNMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClO3/c1-2-19-15-9-5-7-12(10-18)16(15)20-11-13-6-3-4-8-14(13)17/h3-9,18H,2,10-11H2,1H3.
What are the key properties of [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol?
[2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol has a molecular weight of 292.76 g/mol, XLogP of 3.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-chlorophenyl)methoxy]-3-ethoxyphenyl]methanol is sourced from PubChem (CID 4736676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).