2-(2-amino-4-chlorophenoxy)phenol

C12H10ClNO2 — CID 130156009

IUPAC2-(2-amino-4-chlorophenoxy)phenol
SMILESNc1cc(Cl)ccc1Oc1ccccc1O
InChIInChI=1S/C12H10ClNO2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h1-7,15H,14H2
InChIKeyXKQUQWBDTODRBE-UHFFFAOYSA-N
MW235.67 g/mol
LogP3.42
Rot. Bonds2

About 2-(2-amino-4-chlorophenoxy)phenol

2-(2-amino-4-chlorophenoxy)phenol (PubChem CID 130156009) has the molecular formula C12H10ClNO2 and a molecular weight of 235.67 g/mol. Its IUPAC name is 2-(2-amino-4-chlorophenoxy)phenol.

Molecular Properties

Compound Name2-(2-amino-4-chlorophenoxy)phenol
PubChem CID130156009
Molecular FormulaC12H10ClNO2
Molecular Weight235.67 g/mol
Exact Mass235.04
IUPAC Name2-(2-amino-4-chlorophenoxy)phenol
SMILESNc1cc(Cl)ccc1Oc1ccccc1O
InChIInChI=1S/C12H10ClNO2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h1-7,15H,14H2
InChIKeyXKQUQWBDTODRBE-UHFFFAOYSA-N
XLogP3.42
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.67
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-amino-4-chlorophenoxy)-2-chlorobenzoic acid
CID 125468152
2-(2-hydroxyphenoxy)phenol;phosphane
CID 174791785
3-amino-4-(2-fluorophenoxy)phenol
CID 14722258
2-aminophenol;2-(2-aminophenoxy)aniline
CID 174452334
4-(2-aminophenoxy)-3-chloroaniline
CID 66486738
5-chloro-2-(3-iodophenoxy)aniline
CID 43144795
N-[3-(2-amino-4-chlorophenoxy)phenyl]acetamide
CID 26189302
[4-(2-amino-4-chlorophenoxy)-3-methoxyphenyl]methanol
CID 107742518
sodium 2-(2-amino-4-chlorophenoxy)-5-chlorobenzenesulfonate
CID 45358016
2-(2-bromo-4-methoxyphenoxy)-5-chloroaniline
CID 113443527
5-bromo-2-(2-bromo-4-chlorophenoxy)aniline
CID 29302429
5-chloro-2-(2,4-dichlorophenoxy)phenol;ethanol
CID 67724550

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-4-chlorophenoxy)phenol?
The IUPAC name of 2-(2-amino-4-chlorophenoxy)phenol (CID 130156009) is 2-(2-amino-4-chlorophenoxy)phenol.
What is the SMILES notation for 2-(2-amino-4-chlorophenoxy)phenol?
The canonical SMILES for 2-(2-amino-4-chlorophenoxy)phenol is Nc1cc(Cl)ccc1Oc1ccccc1O.
What is the InChIKey of 2-(2-amino-4-chlorophenoxy)phenol?
The InChIKey is XKQUQWBDTODRBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNO2/c13-8-5-6-11(9(14)7-8)16-12-4-2-1-3-10(12)15/h1-7,15H,14H2.
What are the key properties of 2-(2-amino-4-chlorophenoxy)phenol?
2-(2-amino-4-chlorophenoxy)phenol has a molecular weight of 235.67 g/mol, XLogP of 3.42, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-4-chlorophenoxy)phenol is sourced from PubChem (CID 130156009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).