| CAS Number | 20366-59-0 |
| Catalog Number | AG00292H(AGN-PC-0JO2I0) |
| Chemical Name | 1-Bromo-5-methylnaphthalene |
| IUPAC Name | 1-bromo-5-methylnaphthalene |
| InChI | InChI=1S/C11H9Br/c1-8-4-2-6-10-9(8)5-3-7-11(10)12/h2-7H,1H3 |
| InChI Key | QFRWNUJVZXCUJG-UHFFFAOYSA-N |
| MDL Number | MFCD17012226 |
| Molecular Formula | C11H9Br |
| Molecular Weight | 221.0932 |
| NSC Number | 113045 |
| SMILES | CC1=C2C(C(=CC=C2)Br)=CC=C1 |
| Synonyms | 1-bromo-5-methylnaphthalene,
20366-59-0,
NSC113045,
AC1L6OVT,
AC1Q26ZM,
5-Bromo-1-methylnaphthalene,
SCHEMBL7836756,
CTK4E4055,
Naphthalene, 1-bromo-5-methyl-,
DTXSID90296995,
ZINC1704050,
AKOS024438701,
NE61000,
NSC-113045,
DB-083607,
FT-0746101,
Z2756841920,
AR-1C2020,
CID270563,
2047-23-6,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.989g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 221.097g/mol |
| Monoisotopic Mass | 219.989g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.2 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
\N
|
|
Hazard statements
|
H302-H315-H319-H335
|
|
Packing Group
|
\N
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
\N
|
Certificate of Analysis
Lot Number