(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol

C17H19ClO3 — CID 63365402

IUPAC(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(OCc2cc(Cl)ccc2OC)cc1
InChIInChI=1S/C17H19ClO3/c1-3-16(19)12-4-7-15(8-5-12)21-11-13-10-14(18)6-9-17(13)20-2/h4-10,16,19H,3,11H2,1-2H3/t16-/m1/s1
InChIKeyKEMFWFDSGGOUJC-MRXNPFEDSA-N
MW306.79 g/mol
LogP4.37
Rot. Bonds6

About (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol

(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol (PubChem CID 63365402) has the molecular formula C17H19ClO3 and a molecular weight of 306.79 g/mol. Its IUPAC name is (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol
PubChem CID63365402
Molecular FormulaC17H19ClO3
Molecular Weight306.79 g/mol
Exact Mass306.10
IUPAC Name(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(OCc2cc(Cl)ccc2OC)cc1
InChIInChI=1S/C17H19ClO3/c1-3-16(19)12-4-7-15(8-5-12)21-11-13-10-14(18)6-9-17(13)20-2/h4-10,16,19H,3,11H2,1-2H3/t16-/m1/s1
InChIKeyKEMFWFDSGGOUJC-MRXNPFEDSA-N
XLogP4.37
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.79
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 43424347
(1S)-1-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]propan-1-ol
CID 78934350
(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol
CID 106864374
4-chloro-2-[(3-chlorophenoxy)methyl]-1-methoxybenzene
CID 64764179
N-[[5-[(5-chloro-2-methoxyphenyl)methoxy]-2-pyridinyl]methyl]ethanamine
CID 79782260
1-[4-[(2,3-dichlorophenyl)methoxy]phenyl]propan-1-ol
CID 107306798
[2-[(5-chloro-2-methoxyphenyl)methoxy]-4-methoxyphenyl]methanol
CID 61268126
(1R)-1-(3,4-dimethoxyphenyl)propan-1-ol
CID 873110
(1R)-1-[2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]ethanol
CID 63364799
4-bromo-2-[(4-butan-2-ylphenoxy)methyl]-1-methoxybenzene
CID 107667675
(1S)-1-[4-[(2,6-dichlorophenyl)methoxy]phenyl]propan-1-ol
CID 63532785
[3,5-dichloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanol
CID 43646746

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol?
The IUPAC name of (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol (CID 63365402) is (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol?
The canonical SMILES for (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol is CC[C@@H](O)c1ccc(OCc2cc(Cl)ccc2OC)cc1.
What is the InChIKey of (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol?
The InChIKey is KEMFWFDSGGOUJC-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H19ClO3/c1-3-16(19)12-4-7-15(8-5-12)21-11-13-10-14(18)6-9-17(13)20-2/h4-10,16,19H,3,11H2,1-2H3/t16-/m1/s1.
What are the key properties of (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol?
(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol has a molecular weight of 306.79 g/mol, XLogP of 4.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol is sourced from PubChem (CID 63365402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).