4-amino-2-chloro-6-ethoxyphenol

C8H10ClNO2 — CID 86120469

IUPAC4-amino-2-chloro-6-ethoxyphenol
SMILESCCOc1cc(N)cc(Cl)c1O
InChIInChI=1S/C8H10ClNO2/c1-2-12-7-4-5(10)3-6(9)8(7)11/h3-4,11H,2,10H2,1H3
InChIKeyGLVAEJFLAPKDNY-UHFFFAOYSA-N
MW187.63 g/mol
LogP2.03
Rot. Bonds2

About 4-amino-2-chloro-6-ethoxyphenol

4-amino-2-chloro-6-ethoxyphenol (PubChem CID 86120469) has the molecular formula C8H10ClNO2 and a molecular weight of 187.63 g/mol. Its IUPAC name is 4-amino-2-chloro-6-ethoxyphenol.

Molecular Properties

Compound Name4-amino-2-chloro-6-ethoxyphenol
PubChem CID86120469
Molecular FormulaC8H10ClNO2
Molecular Weight187.63 g/mol
Exact Mass187.04
IUPAC Name4-amino-2-chloro-6-ethoxyphenol
SMILESCCOc1cc(N)cc(Cl)c1O
InChIInChI=1S/C8H10ClNO2/c1-2-12-7-4-5(10)3-6(9)8(7)11/h3-4,11H,2,10H2,1H3
InChIKeyGLVAEJFLAPKDNY-UHFFFAOYSA-N
XLogP2.03
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.63
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-4,5-diethoxyaniline
CID 13335752
methyl 3-chloro-5-ethoxy-4-hydroxybenzoate
CID 83953268
2-chloro-6-ethoxy-4-nitrophenol
CID 71327079
4-amino-2-ethoxyphenol
CID 12856010
4-amino-2-chloro-6-ethylphenol
CID 91674507
4-[2-(aminomethyl)-3-hydroxypropyl]-2-chloro-6-ethoxyphenol
CID 83977198
2-chloro-4-ethoxynaphthalen-1-ol
CID 121473034
(3-chloro-5-ethoxy-4-hydroxyphenyl)-(4-methylpiperazin-1-yl)methanethione
CID 135578993
[(3-chloro-5-ethoxy-4-hydroxyphenyl)methylideneamino]thiourea
CID 4542145
2-(4-chlorophenoxy)ethyl 3-chloro-5-ethoxy-4-hydroxybenzoate
CID 7358999
(3-chloro-5-ethoxy-4-hydroxyphenyl)-(4-methylpiperidin-1-yl)methanethione
CID 137059437
2-chloro-6-ethoxy-4-[(4-ethoxyanilino)methyl]phenol
CID 83455060

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-chloro-6-ethoxyphenol?
The IUPAC name of 4-amino-2-chloro-6-ethoxyphenol (CID 86120469) is 4-amino-2-chloro-6-ethoxyphenol.
What is the SMILES notation for 4-amino-2-chloro-6-ethoxyphenol?
The canonical SMILES for 4-amino-2-chloro-6-ethoxyphenol is CCOc1cc(N)cc(Cl)c1O.
What is the InChIKey of 4-amino-2-chloro-6-ethoxyphenol?
The InChIKey is GLVAEJFLAPKDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClNO2/c1-2-12-7-4-5(10)3-6(9)8(7)11/h3-4,11H,2,10H2,1H3.
What are the key properties of 4-amino-2-chloro-6-ethoxyphenol?
4-amino-2-chloro-6-ethoxyphenol has a molecular weight of 187.63 g/mol, XLogP of 2.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-chloro-6-ethoxyphenol is sourced from PubChem (CID 86120469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).