2-chloro-4-(2-chloronaphthalen-1-yl)phenol

C16H10Cl2O — CID 174790490

IUPAC2-chloro-4-(2-chloronaphthalen-1-yl)phenol
SMILESOc1ccc(-c2c(Cl)ccc3ccccc23)cc1Cl
InChIInChI=1S/C16H10Cl2O/c17-13-7-5-10-3-1-2-4-12(10)16(13)11-6-8-15(19)14(18)9-11/h1-9,19H
InChIKeyYMTCSLWRYXFDPP-UHFFFAOYSA-N
MW289.16 g/mol
LogP5.52
Rot. Bonds1

About 2-chloro-4-(2-chloronaphthalen-1-yl)phenol

2-chloro-4-(2-chloronaphthalen-1-yl)phenol (PubChem CID 174790490) has the molecular formula C16H10Cl2O and a molecular weight of 289.16 g/mol. Its IUPAC name is 2-chloro-4-(2-chloronaphthalen-1-yl)phenol.

Molecular Properties

Compound Name2-chloro-4-(2-chloronaphthalen-1-yl)phenol
PubChem CID174790490
Molecular FormulaC16H10Cl2O
Molecular Weight289.16 g/mol
Exact Mass288.01
IUPAC Name2-chloro-4-(2-chloronaphthalen-1-yl)phenol
SMILESOc1ccc(-c2c(Cl)ccc3ccccc23)cc1Cl
InChIInChI=1S/C16H10Cl2O/c17-13-7-5-10-3-1-2-4-12(10)16(13)11-6-8-15(19)14(18)9-11/h1-9,19H
InChIKeyYMTCSLWRYXFDPP-UHFFFAOYSA-N
XLogP5.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500289.16
LogP ≤ 55.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
CID 90766733
2-chloro-4-phthalazin-1-ylphenol
CID 150345574
5-[4-(2-chloronaphthalen-1-yl)phenyl]-3,4-dihydroxy-5-methylfuran-2-one
CID 54708208
3-chloro-1-(3-chloro-2-hydroxynaphthalen-1-yl)naphthalen-2-ol;titanium(2+)
CID 23311022
1-(4-aminophenyl)naphthalen-2-ol
CID 71327010
tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
4-anthracen-9-yl-2-methylphenol
CID 156873853
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
1-(4-chloro-2-fluorophenyl)naphthalen-2-ol
CID 146212373
1-(3,4,5-trimethoxyphenyl)naphthalen-2-ol
CID 102188168
1-(2,3-dibromonaphthalen-1-yl)naphthalen-2-ol
CID 67157613
1-iodonaphthalen-2-ol
CID 16250

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(2-chloronaphthalen-1-yl)phenol?
The IUPAC name of 2-chloro-4-(2-chloronaphthalen-1-yl)phenol (CID 174790490) is 2-chloro-4-(2-chloronaphthalen-1-yl)phenol.
What is the SMILES notation for 2-chloro-4-(2-chloronaphthalen-1-yl)phenol?
The canonical SMILES for 2-chloro-4-(2-chloronaphthalen-1-yl)phenol is Oc1ccc(-c2c(Cl)ccc3ccccc23)cc1Cl.
What is the InChIKey of 2-chloro-4-(2-chloronaphthalen-1-yl)phenol?
The InChIKey is YMTCSLWRYXFDPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2O/c17-13-7-5-10-3-1-2-4-12(10)16(13)11-6-8-15(19)14(18)9-11/h1-9,19H.
What are the key properties of 2-chloro-4-(2-chloronaphthalen-1-yl)phenol?
2-chloro-4-(2-chloronaphthalen-1-yl)phenol has a molecular weight of 289.16 g/mol, XLogP of 5.52, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(2-chloronaphthalen-1-yl)phenol is sourced from PubChem (CID 174790490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).