| CAS Number | 29016-72-6 |
| Catalog Number | AG002V7W(AGN-PC-0NIOXU) |
| Chemical Name | Naphthalene, 1-bromo-7-chloro- |
| IUPAC Name | 1-bromo-7-chloronaphthalene |
| InChI | InChI=1S/C10H6BrCl/c11-10-3-1-2-7-4-5-8(12)6-9(7)10/h1-6H |
| InChI Key | DVVPHXPGHQNPNW-UHFFFAOYSA-N |
| MDL Number | MFCD17012255 |
| Molecular Formula | C10H6BrCl |
| Molecular Weight | 241.5116 |
| SMILES | BrC1=CC=CC2=CC=C(C=C12)Cl |
| Synonyms | 1-Bromo-7-chloronaphthalene,
29016-72-6,
Naphthalene, 1-bromo-7-chloro-,
CTK0J1628,
DTXSID10492917,
MFCD17012255,
ZINC71256611,
AKOS024438583,
DB-083647,
CS-0060604,
FT-0718979,
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| Complexity | 160 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.934g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.512g/mol |
| Monoisotopic Mass | 239.934g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
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Certificate of Analysis
Lot Number