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

C17H19ClO2 — CID 106864374

IUPAC(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(OCc2ccc(C)cc2Cl)cc1
InChIInChI=1S/C17H19ClO2/c1-3-17(19)13-6-8-15(9-7-13)20-11-14-5-4-12(2)10-16(14)18/h4-10,17,19H,3,11H2,1-2H3/t17-/m1/s1
InChIKeyRVEHDQASZQNHTK-QGZVFWFLSA-N
MW290.79 g/mol
LogP4.67
Rot. Bonds5

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

(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol (PubChem CID 106864374) has the molecular formula C17H19ClO2 and a molecular weight of 290.79 g/mol. Its IUPAC name is (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol
PubChem CID106864374
Molecular FormulaC17H19ClO2
Molecular Weight290.79 g/mol
Exact Mass290.11
IUPAC Name(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol
SMILESCC[C@@H](O)c1ccc(OCc2ccc(C)cc2Cl)cc1
InChIInChI=1S/C17H19ClO2/c1-3-17(19)13-6-8-15(9-7-13)20-11-14-5-4-12(2)10-16(14)18/h4-10,17,19H,3,11H2,1-2H3/t17-/m1/s1
InChIKeyRVEHDQASZQNHTK-QGZVFWFLSA-N
XLogP4.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]ethanol
CID 106864305
(1S)-1-[4-[(2-methoxy-5-methylphenyl)methoxy]phenyl]propan-1-ol
CID 78934350
1-[4-[(2,3-dichlorophenyl)methoxy]phenyl]propan-1-ol
CID 107306798
(1S)-1-[4-[(2,6-dichlorophenyl)methoxy]phenyl]propan-1-ol
CID 63532785
(1R)-1-[4-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]propan-1-ol
CID 63365402
(1R)-1-[4-[(2-bromo-4-fluorophenyl)methoxy]phenyl]propan-1-ol
CID 63365654
1-bromo-4-[(2-chloro-4-methylphenyl)methoxy]-2-methylbenzene
CID 106863672
1-[2-[(2-chloro-4-methylphenyl)methoxy]-5-methylphenyl]ethanol
CID 106864318
N-(2-chloro-4,6-dimethylphenyl)-2-[4-(1-hydroxypropyl)phenoxy]acetamide
CID 110884676
1-(2-chloro-4-methylphenyl)-3-(4-chlorophenoxy)propan-2-ol
CID 106868107
(1R)-1-(4-methylphenyl)propan-1-ol;propane
CID 144859103
1-(4-butoxyphenyl)propan-1-ol
CID 19979001

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol?
The IUPAC name of (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol (CID 106864374) is (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol?
The canonical SMILES for (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol is CC[C@@H](O)c1ccc(OCc2ccc(C)cc2Cl)cc1.
What is the InChIKey of (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol?
The InChIKey is RVEHDQASZQNHTK-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H19ClO2/c1-3-17(19)13-6-8-15(9-7-13)20-11-14-5-4-12(2)10-16(14)18/h4-10,17,19H,3,11H2,1-2H3/t17-/m1/s1.
What are the key properties of (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol?
(1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol has a molecular weight of 290.79 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[4-[(2-chloro-4-methylphenyl)methoxy]phenyl]propan-1-ol is sourced from PubChem (CID 106864374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).