| CAS Number | 102154-19-8 |
| Catalog Number | AG0006RX(AGN-PC-03LJBN) |
| Chemical Name | 2-Chloronaphthalene-1-sulfonyl chloride |
| IUPAC Name | 2-chloronaphthalene-1-sulfonyl chloride |
| InChI | InChI=1S/C10H6Cl2O2S/c11-9-6-5-7-3-1-2-4-8(7)10(9)15(12,13)14/h1-6H |
| InChI Key | SPRZLGGRDIRMRD-UHFFFAOYSA-N |
| MDL Number | MFCD22196559 |
| Molecular Formula | C10H6Cl2O2S |
| Molecular Weight | 261.1244 |
| SMILES | ClC1=C(S(Cl)(=O)=O)C2=C(C=CC=C2)C=C1 |
| Synonyms | 2-chloronaphthalene-1-sulfonyl chloride,
102154-19-8,
1-Naphthalenesulfonyl chloride, 2-chloro-,
ACMC-20m569,
SCHEMBL1036724,
CTK0D9215,
DTXSID10623284,
ZINC100442719,
NE45864,
RP29299,
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| Complexity | 323 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 259.947g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 261.116g/mol |
| Monoisotopic Mass | 259.947g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
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Certificate of Analysis
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