2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride

C16H10Cl2O3S — CID 18705215

IUPAC2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccccc1Oc1ccc2ccccc2c1Cl
InChIInChI=1S/C16H10Cl2O3S/c17-16-12-6-2-1-5-11(12)9-10-14(16)21-13-7-3-4-8-15(13)22(18,19)20/h1-10H
InChIKeyMMMGVNOTHGTGJG-UHFFFAOYSA-N
MW353.23 g/mol
LogP5.21
Rot. Bonds3

About 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride

2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride (PubChem CID 18705215) has the molecular formula C16H10Cl2O3S and a molecular weight of 353.23 g/mol. Its IUPAC name is 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride.

Molecular Properties

Compound Name2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride
PubChem CID18705215
Molecular FormulaC16H10Cl2O3S
Molecular Weight353.23 g/mol
Exact Mass351.97
IUPAC Name2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride
SMILESO=S(=O)(Cl)c1ccccc1Oc1ccc2ccccc2c1Cl
InChIInChI=1S/C16H10Cl2O3S/c17-16-12-6-2-1-5-11(12)9-10-14(16)21-13-7-3-4-8-15(13)22(18,19)20/h1-10H
InChIKeyMMMGVNOTHGTGJG-UHFFFAOYSA-N
XLogP5.21
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.23
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-2-(1-chloronaphthalen-2-yl)oxynaphthalene
CID 176912299
2-(4-chlorophenoxy)benzenesulfonyl chloride
CID 18687924
1-chloronaphthalene-2-sulfonic acid
CID 14389107
2-naphthalen-1-yloxy-1-(2-naphthalen-1-yloxynaphthalen-1-yl)naphthalene
CID 58689928
2-(3,4,5-trimethylphenoxy)benzenesulfonyl chloride
CID 18791826
2-[4-(trifluoromethyl)phenoxy]benzenesulfonyl chloride
CID 87588000
2-butoxybenzenesulfonyl chloride
CID 21253032
2-(2-methoxyethoxy)benzenesulfonyl chloride
CID 75466193
2-(2-chlorosulfonylphenoxy)acetic acid
CID 54560500
2-pentoxybenzenesulfonyl chloride
CID 87516954
naphthalene-2,3-disulfonyl chloride
CID 134894919
5-chloro-2-naphthalen-1-yloxybenzaldehyde
CID 114844762

Frequently Asked Questions

What is the IUPAC name of 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride?
The IUPAC name of 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride (CID 18705215) is 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride.
What is the SMILES notation for 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride?
The canonical SMILES for 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride is O=S(=O)(Cl)c1ccccc1Oc1ccc2ccccc2c1Cl.
What is the InChIKey of 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride?
The InChIKey is MMMGVNOTHGTGJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2O3S/c17-16-12-6-2-1-5-11(12)9-10-14(16)21-13-7-3-4-8-15(13)22(18,19)20/h1-10H.
What are the key properties of 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride?
2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride has a molecular weight of 353.23 g/mol, XLogP of 5.21, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-chloronaphthalen-2-yl)oxybenzenesulfonyl chloride is sourced from PubChem (CID 18705215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).