(1R)-1-(2-nonoxyphenyl)ethanol

C17H28O2 — CID 78944592

IUPAC(1R)-1-(2-nonoxyphenyl)ethanol
SMILESCCCCCCCCCOc1ccccc1[C@@H](C)O
InChIInChI=1S/C17H28O2/c1-3-4-5-6-7-8-11-14-19-17-13-10-9-12-16(17)15(2)18/h9-10,12-13,15,18H,3-8,11,14H2,1-2H3/t15-/m1/s1
InChIKeyBJYAPJHMJDKYQE-OAHLLOKOSA-N
MW264.41 g/mol
LogP4.87
Rot. Bonds10

About (1R)-1-(2-nonoxyphenyl)ethanol

(1R)-1-(2-nonoxyphenyl)ethanol (PubChem CID 78944592) has the molecular formula C17H28O2 and a molecular weight of 264.41 g/mol. Its IUPAC name is (1R)-1-(2-nonoxyphenyl)ethanol.

Molecular Properties

Compound Name(1R)-1-(2-nonoxyphenyl)ethanol
PubChem CID78944592
Molecular FormulaC17H28O2
Molecular Weight264.41 g/mol
Exact Mass264.21
IUPAC Name(1R)-1-(2-nonoxyphenyl)ethanol
SMILESCCCCCCCCCOc1ccccc1[C@@H](C)O
InChIInChI=1S/C17H28O2/c1-3-4-5-6-7-8-11-14-19-17-13-10-9-12-16(17)15(2)18/h9-10,12-13,15,18H,3-8,11,14H2,1-2H3/t15-/m1/s1
InChIKeyBJYAPJHMJDKYQE-OAHLLOKOSA-N
XLogP4.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.41
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(1S)-1-(2-octoxyphenyl)ethanol
CID 55223229
1-(2-propoxyphenyl)ethanol
CID 43503976
5-[2-[(1R)-1-hydroxyethyl]phenoxy]pentan-1-ol
CID 63364920
1-octoxy-2-propan-2-ylbenzene
CID 64765685
(1S)-1-(2-hexoxyphenyl)propan-1-ol
CID 78930140
1-(2-heptoxyphenyl)propan-1-ol
CID 43503487
(1S)-1-(2-heptoxyphenyl)propan-1-ol
CID 78944609
2-amino-1-(2-hexoxyphenyl)ethanol
CID 102543640
(1R)-2-amino-1-(2-hexoxyphenyl)ethanol
CID 124500421
(1S)-1-(2-heptoxyphenyl)ethanamine
CID 78936557
(1S)-1-(2-octoxyphenyl)ethanamine
CID 78944069
1-[2-(4-methylpentoxy)phenyl]ethanol
CID 112684876

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2-nonoxyphenyl)ethanol?
The IUPAC name of (1R)-1-(2-nonoxyphenyl)ethanol (CID 78944592) is (1R)-1-(2-nonoxyphenyl)ethanol.
What is the SMILES notation for (1R)-1-(2-nonoxyphenyl)ethanol?
The canonical SMILES for (1R)-1-(2-nonoxyphenyl)ethanol is CCCCCCCCCOc1ccccc1[C@@H](C)O.
What is the InChIKey of (1R)-1-(2-nonoxyphenyl)ethanol?
The InChIKey is BJYAPJHMJDKYQE-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H28O2/c1-3-4-5-6-7-8-11-14-19-17-13-10-9-12-16(17)15(2)18/h9-10,12-13,15,18H,3-8,11,14H2,1-2H3/t15-/m1/s1.
What are the key properties of (1R)-1-(2-nonoxyphenyl)ethanol?
(1R)-1-(2-nonoxyphenyl)ethanol has a molecular weight of 264.41 g/mol, XLogP of 4.87, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2-nonoxyphenyl)ethanol is sourced from PubChem (CID 78944592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).