| CAS Number | 137354-54-2 |
| Catalog Number | AG001360(AGN-PC-0JOWKD) |
| Chemical Name | 4-(Bromomethyl)-2-chloroquinoline |
| IUPAC Name | 4-(bromomethyl)-2-chloroquinoline |
| InChI | InChI=1S/C10H7BrClN/c11-6-7-5-10(12)13-9-4-2-1-3-8(7)9/h1-5H,6H2 |
| InChI Key | RHANOADKGPRUKT-UHFFFAOYSA-N |
| MDL Number | MFCD12910754 |
| Molecular Formula | C10H7BrClN |
| Molecular Weight | 256.5263 |
| NSC Number | 246075 |
| SMILES | ClC1=NC2=C(C=CC=C2)C(CBr)=C1 |
| Synonyms | 4-BROMOMETHYL-2-CHLOROQUINOLINE,
137354-54-2,
4-(bromomethyl)-2-chloroquinoline,
Quinoline, 4-(bromomethyl)-2-chloro-,
NSC246075,
AC1L7V2E,
SCHEMBL832390,
DTXSID10311856,
RHANOADKGPRUKT-UHFFFAOYSA-N,
ZINC1766347,
MFCD12910754,
AKOS025402863,
NSC-246075,
AS-31828,
X-3316,
CID316989,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.527g/mol |
| Monoisotopic Mass | 254.945g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H302-H314
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P280-P305+P351+P338-P310
|
|
UN Code
|
UN 1759
|
Certificate of Analysis
Lot Number