4-(dimethylamino)phenol;hydrochloride

C8H12ClNO — CID 22173

IUPAC4-(dimethylamino)phenol;hydrochloride
SMILESCN(C)c1ccc(O)cc1.Cl
InChIInChI=1S/C8H11NO.ClH/c1-9(2)7-3-5-8(10)6-4-7;/h3-6,10H,1-2H3;1H
InChIKeyFGBQWWREKHAJIX-UHFFFAOYSA-N
MW173.64 g/mol
LogP1.88
Rot. Bonds1

About 4-(dimethylamino)phenol;hydrochloride

4-(dimethylamino)phenol;hydrochloride (PubChem CID 22173) has the molecular formula C8H12ClNO and a molecular weight of 173.64 g/mol. Its IUPAC name is 4-(dimethylamino)phenol;hydrochloride.

Molecular Properties

Compound Name4-(dimethylamino)phenol;hydrochloride
PubChem CID22173
Molecular FormulaC8H12ClNO
Molecular Weight173.64 g/mol
Exact Mass173.06
IUPAC Name4-(dimethylamino)phenol;hydrochloride
SMILESCN(C)c1ccc(O)cc1.Cl
InChIInChI=1S/C8H11NO.ClH/c1-9(2)7-3-5-8(10)6-4-7;/h3-6,10H,1-2H3;1H
InChIKeyFGBQWWREKHAJIX-UHFFFAOYSA-N
XLogP1.88
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.64
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)phenol;hydrochloride?
The IUPAC name of 4-(dimethylamino)phenol;hydrochloride (CID 22173) is 4-(dimethylamino)phenol;hydrochloride.
What is the SMILES notation for 4-(dimethylamino)phenol;hydrochloride?
The canonical SMILES for 4-(dimethylamino)phenol;hydrochloride is CN(C)c1ccc(O)cc1.Cl.
What is the InChIKey of 4-(dimethylamino)phenol;hydrochloride?
The InChIKey is FGBQWWREKHAJIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO.ClH/c1-9(2)7-3-5-8(10)6-4-7;/h3-6,10H,1-2H3;1H.
What are the key properties of 4-(dimethylamino)phenol;hydrochloride?
4-(dimethylamino)phenol;hydrochloride has a molecular weight of 173.64 g/mol, XLogP of 1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(dimethylamino)phenol;hydrochloride is sourced from PubChem (CID 22173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).