4-(2-chloro-5-hydroxypentyl)phenol

C11H15ClO2 — CID 175603812

IUPAC4-(2-chloro-5-hydroxypentyl)phenol
SMILESOCCCC(Cl)Cc1ccc(O)cc1
InChIInChI=1S/C11H15ClO2/c12-10(2-1-7-13)8-9-3-5-11(14)6-4-9/h3-6,10,13-14H,1-2,7-8H2
InChIKeyFUYXGQRXAKPZDH-UHFFFAOYSA-N
MW214.69 g/mol
LogP2.31
Rot. Bonds5

About 4-(2-chloro-5-hydroxypentyl)phenol

4-(2-chloro-5-hydroxypentyl)phenol (PubChem CID 175603812) has the molecular formula C11H15ClO2 and a molecular weight of 214.69 g/mol. Its IUPAC name is 4-(2-chloro-5-hydroxypentyl)phenol.

Molecular Properties

Compound Name4-(2-chloro-5-hydroxypentyl)phenol
PubChem CID175603812
Molecular FormulaC11H15ClO2
Molecular Weight214.69 g/mol
Exact Mass214.08
IUPAC Name4-(2-chloro-5-hydroxypentyl)phenol
SMILESOCCCC(Cl)Cc1ccc(O)cc1
InChIInChI=1S/C11H15ClO2/c12-10(2-1-7-13)8-9-3-5-11(14)6-4-9/h3-6,10,13-14H,1-2,7-8H2
InChIKeyFUYXGQRXAKPZDH-UHFFFAOYSA-N
XLogP2.31
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(1R)-1-(4-hydroxyphenyl)butane-1,4-diol
CID 23836266
4-(12-hydroxydodecyl)phenol
CID 139809285
4-(2,6,8-trimethylnonyl)phenol
CID 155208815
3-(5-hydroxypentan-2-yl)-1-[1-(4-hydroxyphenyl)propan-2-yl]-1-methylurea
CID 109390126
(2S,3S)-2,3-bis[(4-hydroxyphenyl)methyl]hexanedioic acid
CID 172870226
4-[2-(4-hydroxyphenyl)but-3-ynyl]phenol
CID 10955612
N-[2-chloro-3-(4-hydroxyphenyl)propyl]prop-2-enamide
CID 67517329
1-(2-chlorodecyl)-4-fluorobenzene
CID 65428544
1-(4-hydroxyphenyl)heptane-2,3-diol
CID 91525672
4-[3-hydroxy-4-(4-hydroxyphenyl)butyl]phenol
CID 66690172
4-[(2R)-2-amino-3-hydroxypropyl]phenol;ethane
CID 143560226
4-(4-methyl-5-phenylpentyl)phenol
CID 158681288

Frequently Asked Questions

What is the IUPAC name of 4-(2-chloro-5-hydroxypentyl)phenol?
The IUPAC name of 4-(2-chloro-5-hydroxypentyl)phenol (CID 175603812) is 4-(2-chloro-5-hydroxypentyl)phenol.
What is the SMILES notation for 4-(2-chloro-5-hydroxypentyl)phenol?
The canonical SMILES for 4-(2-chloro-5-hydroxypentyl)phenol is OCCCC(Cl)Cc1ccc(O)cc1.
What is the InChIKey of 4-(2-chloro-5-hydroxypentyl)phenol?
The InChIKey is FUYXGQRXAKPZDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClO2/c12-10(2-1-7-13)8-9-3-5-11(14)6-4-9/h3-6,10,13-14H,1-2,7-8H2.
What are the key properties of 4-(2-chloro-5-hydroxypentyl)phenol?
4-(2-chloro-5-hydroxypentyl)phenol has a molecular weight of 214.69 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chloro-5-hydroxypentyl)phenol is sourced from PubChem (CID 175603812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).