2-(aminooxymethyl)-6-chlorophenol

C7H8ClNO2 — CID 117277054

IUPAC2-(aminooxymethyl)-6-chlorophenol
SMILESNOCc1cccc(Cl)c1O
InChIInChI=1S/C7H8ClNO2/c8-6-3-1-2-5(4-11-9)7(6)10/h1-3,10H,4,9H2
InChIKeyHIRABKOPGBEUKY-UHFFFAOYSA-N
MW173.60 g/mol
LogP1.44
Rot. Bonds2

About 2-(aminooxymethyl)-6-chlorophenol

2-(aminooxymethyl)-6-chlorophenol (PubChem CID 117277054) has the molecular formula C7H8ClNO2 and a molecular weight of 173.60 g/mol. Its IUPAC name is 2-(aminooxymethyl)-6-chlorophenol.

Molecular Properties

Compound Name2-(aminooxymethyl)-6-chlorophenol
PubChem CID117277054
Molecular FormulaC7H8ClNO2
Molecular Weight173.60 g/mol
Exact Mass173.02
IUPAC Name2-(aminooxymethyl)-6-chlorophenol
SMILESNOCc1cccc(Cl)c1O
InChIInChI=1S/C7H8ClNO2/c8-6-3-1-2-5(4-11-9)7(6)10/h1-3,10H,4,9H2
InChIKeyHIRABKOPGBEUKY-UHFFFAOYSA-N
XLogP1.44
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.60
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

O-[[3-chloro-2-(difluoromethyl)phenyl]methyl]hydroxylamine
CID 117296938
2-(aminooxymethyl)-6-(trifluoromethyl)phenol
CID 117295390
3-(aminooxymethyl)-6-chloro-2-methoxyphenol
CID 117292180
2-chloro-6-[(2-hydroxyphenyl)methyl]phenol
CID 22151945
O-[(2-chloro-3-methylphenyl)methyl]hydroxylamine
CID 117276900
2-chloro-6-(nitrosomethyl)phenol
CID 91373743
2-chloro-6-(methylaminomethyl)phenol;hydrochloride
CID 135396200
O-[(7-chloro-1-benzofuran-3-yl)methyl]hydroxylamine
CID 117197472
3-(3-chloro-2-hydroxyphenyl)propanoic acid
CID 54416196
2-chloro-6-[[2-(methoxymethyl)anilino]methyl]phenol
CID 112553795
O-[(3-chloro-1-methylindol-7-yl)methyl]hydroxylamine
CID 117300853
2-chloro-6-[2-(methylamino)propyl]phenol
CID 84733707

Frequently Asked Questions

What is the IUPAC name of 2-(aminooxymethyl)-6-chlorophenol?
The IUPAC name of 2-(aminooxymethyl)-6-chlorophenol (CID 117277054) is 2-(aminooxymethyl)-6-chlorophenol.
What is the SMILES notation for 2-(aminooxymethyl)-6-chlorophenol?
The canonical SMILES for 2-(aminooxymethyl)-6-chlorophenol is NOCc1cccc(Cl)c1O.
What is the InChIKey of 2-(aminooxymethyl)-6-chlorophenol?
The InChIKey is HIRABKOPGBEUKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO2/c8-6-3-1-2-5(4-11-9)7(6)10/h1-3,10H,4,9H2.
What are the key properties of 2-(aminooxymethyl)-6-chlorophenol?
2-(aminooxymethyl)-6-chlorophenol has a molecular weight of 173.60 g/mol, XLogP of 1.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminooxymethyl)-6-chlorophenol is sourced from PubChem (CID 117277054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).