2-chloro-4-ethoxynaphthalen-1-ol

C12H11ClO2 — CID 121473034

IUPAC2-chloro-4-ethoxynaphthalen-1-ol
SMILESCCOc1cc(Cl)c(O)c2ccccc12
InChIInChI=1S/C12H11ClO2/c1-2-15-11-7-10(13)12(14)9-6-4-3-5-8(9)11/h3-7,14H,2H2,1H3
InChIKeyHWKASYDACFRSFW-UHFFFAOYSA-N
MW222.67 g/mol
LogP3.60
Rot. Bonds2

About 2-chloro-4-ethoxynaphthalen-1-ol

2-chloro-4-ethoxynaphthalen-1-ol (PubChem CID 121473034) has the molecular formula C12H11ClO2 and a molecular weight of 222.67 g/mol. Its IUPAC name is 2-chloro-4-ethoxynaphthalen-1-ol.

Molecular Properties

Compound Name2-chloro-4-ethoxynaphthalen-1-ol
PubChem CID121473034
Molecular FormulaC12H11ClO2
Molecular Weight222.67 g/mol
Exact Mass222.04
IUPAC Name2-chloro-4-ethoxynaphthalen-1-ol
SMILESCCOc1cc(Cl)c(O)c2ccccc12
InChIInChI=1S/C12H11ClO2/c1-2-15-11-7-10(13)12(14)9-6-4-3-5-8(9)11/h3-7,14H,2H2,1H3
InChIKeyHWKASYDACFRSFW-UHFFFAOYSA-N
XLogP3.60
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.67
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 121473081
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4-amino-2-chloro-6-ethoxyphenol
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1-(2-chlorophenyl)-2-(3,4-diethoxyphenyl)ethane-1,2-dione
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(E)-3-(3-chloro-5-ethoxy-4-hydroxyphenyl)-1-(2-chlorophenyl)prop-2-en-1-one
CID 8833111
3-chloro-5-ethoxy-4-methoxyphenol
CID 121210329
(2-chlorophenyl)-(2-ethoxyphenyl)methanol
CID 62802056
3,4,5-triethoxyphenol
CID 19754898
(2-chloro-4,5-diethoxyphenyl)-phenylmethanone
CID 43340750
6-chloro-8-ethoxy-9-methoxy-5-methylcyclohepta[b]indol-5-ium
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3-chloro-4,5-diethoxybenzoate
CID 7326781

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-ethoxynaphthalen-1-ol?
The IUPAC name of 2-chloro-4-ethoxynaphthalen-1-ol (CID 121473034) is 2-chloro-4-ethoxynaphthalen-1-ol.
What is the SMILES notation for 2-chloro-4-ethoxynaphthalen-1-ol?
The canonical SMILES for 2-chloro-4-ethoxynaphthalen-1-ol is CCOc1cc(Cl)c(O)c2ccccc12.
What is the InChIKey of 2-chloro-4-ethoxynaphthalen-1-ol?
The InChIKey is HWKASYDACFRSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO2/c1-2-15-11-7-10(13)12(14)9-6-4-3-5-8(9)11/h3-7,14H,2H2,1H3.
What are the key properties of 2-chloro-4-ethoxynaphthalen-1-ol?
2-chloro-4-ethoxynaphthalen-1-ol has a molecular weight of 222.67 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-ethoxynaphthalen-1-ol is sourced from PubChem (CID 121473034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).