(1R)-1-(5-chloro-2-propoxyphenyl)ethanol

C11H15ClO2 — CID 63364392

IUPAC(1R)-1-(5-chloro-2-propoxyphenyl)ethanol
SMILESCCCOc1ccc(Cl)cc1[C@@H](C)O
InChIInChI=1S/C11H15ClO2/c1-3-6-14-11-5-4-9(12)7-10(11)8(2)13/h4-5,7-8,13H,3,6H2,1-2H3/t8-/m1/s1
InChIKeyDYLWZCQLPKZCSV-MRVPVSSYSA-N
MW214.69 g/mol
LogP3.18
Rot. Bonds4

About (1R)-1-(5-chloro-2-propoxyphenyl)ethanol

(1R)-1-(5-chloro-2-propoxyphenyl)ethanol (PubChem CID 63364392) has the molecular formula C11H15ClO2 and a molecular weight of 214.69 g/mol. Its IUPAC name is (1R)-1-(5-chloro-2-propoxyphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(5-chloro-2-propoxyphenyl)ethanol
PubChem CID63364392
Molecular FormulaC11H15ClO2
Molecular Weight214.69 g/mol
Exact Mass214.08
IUPAC Name(1R)-1-(5-chloro-2-propoxyphenyl)ethanol
SMILESCCCOc1ccc(Cl)cc1[C@@H](C)O
InChIInChI=1S/C11H15ClO2/c1-3-6-14-11-5-4-9(12)7-10(11)8(2)13/h4-5,7-8,13H,3,6H2,1-2H3/t8-/m1/s1
InChIKeyDYLWZCQLPKZCSV-MRVPVSSYSA-N
XLogP3.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-chloro-2-heptoxyphenyl)ethanol
CID 63533676
(1S)-1-(5-chloro-2-heptoxyphenyl)ethanol
CID 63533695
(1S)-1-(5-chloro-2-decoxyphenyl)ethanol
CID 78944253
(1S)-1-(5-chloro-2-hexoxyphenyl)ethanol
CID 78931549
1-[5-chloro-2-(3-ethoxypropoxy)phenyl]ethanol
CID 65175757
(1S)-1-[5-chloro-2-(4-methoxybutoxy)phenyl]ethanol
CID 104648019
(1S)-1-[5-chloro-2-(3-fluoropropoxy)phenyl]ethanol
CID 81113981
(1S)-1-[5-chloro-2-(3-methoxypropoxy)phenyl]ethanol
CID 78931460
(1S)-1-[5-chloro-2-(2-propan-2-yloxyethoxy)phenyl]ethanol
CID 63364452
(1R)-1-[5-chloro-2-[2-(diethylamino)ethoxy]phenyl]ethanol
CID 63364400
(1S)-1-[5-chloro-2-(3,3-dimethylbutoxy)phenyl]ethanol
CID 78931515
5-(5-chloro-2-propoxyphenyl)hexane-2,3-diol
CID 83933462

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-chloro-2-propoxyphenyl)ethanol?
The IUPAC name of (1R)-1-(5-chloro-2-propoxyphenyl)ethanol (CID 63364392) is (1R)-1-(5-chloro-2-propoxyphenyl)ethanol.
What is the SMILES notation for (1R)-1-(5-chloro-2-propoxyphenyl)ethanol?
The canonical SMILES for (1R)-1-(5-chloro-2-propoxyphenyl)ethanol is CCCOc1ccc(Cl)cc1[C@@H](C)O.
What is the InChIKey of (1R)-1-(5-chloro-2-propoxyphenyl)ethanol?
The InChIKey is DYLWZCQLPKZCSV-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H15ClO2/c1-3-6-14-11-5-4-9(12)7-10(11)8(2)13/h4-5,7-8,13H,3,6H2,1-2H3/t8-/m1/s1.
What are the key properties of (1R)-1-(5-chloro-2-propoxyphenyl)ethanol?
(1R)-1-(5-chloro-2-propoxyphenyl)ethanol has a molecular weight of 214.69 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-chloro-2-propoxyphenyl)ethanol is sourced from PubChem (CID 63364392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).