2-(2,3-dichloroanilino)ethanol

C8H9Cl2NO — CID 13210878

IUPAC2-(2,3-dichloroanilino)ethanol
SMILESOCCNc1cccc(Cl)c1Cl
InChIInChI=1S/C8H9Cl2NO/c9-6-2-1-3-7(8(6)10)11-4-5-12/h1-3,11-12H,4-5H2
InChIKeyRSGHDONOLAYJET-UHFFFAOYSA-N
MW206.07 g/mol
LogP2.40
Rot. Bonds3

About 2-(2,3-dichloroanilino)ethanol

2-(2,3-dichloroanilino)ethanol (PubChem CID 13210878) has the molecular formula C8H9Cl2NO and a molecular weight of 206.07 g/mol. Its IUPAC name is 2-(2,3-dichloroanilino)ethanol.

Molecular Properties

Compound Name2-(2,3-dichloroanilino)ethanol
PubChem CID13210878
Molecular FormulaC8H9Cl2NO
Molecular Weight206.07 g/mol
Exact Mass205.01
IUPAC Name2-(2,3-dichloroanilino)ethanol
SMILESOCCNc1cccc(Cl)c1Cl
InChIInChI=1S/C8H9Cl2NO/c9-6-2-1-3-7(8(6)10)11-4-5-12/h1-3,11-12H,4-5H2
InChIKeyRSGHDONOLAYJET-UHFFFAOYSA-N
XLogP2.40
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.07
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichloroanilino)ethanol?
The IUPAC name of 2-(2,3-dichloroanilino)ethanol (CID 13210878) is 2-(2,3-dichloroanilino)ethanol.
What is the SMILES notation for 2-(2,3-dichloroanilino)ethanol?
The canonical SMILES for 2-(2,3-dichloroanilino)ethanol is OCCNc1cccc(Cl)c1Cl.
What is the InChIKey of 2-(2,3-dichloroanilino)ethanol?
The InChIKey is RSGHDONOLAYJET-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9Cl2NO/c9-6-2-1-3-7(8(6)10)11-4-5-12/h1-3,11-12H,4-5H2.
What are the key properties of 2-(2,3-dichloroanilino)ethanol?
2-(2,3-dichloroanilino)ethanol has a molecular weight of 206.07 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichloroanilino)ethanol is sourced from PubChem (CID 13210878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).