| CAS Number | 1330754-37-4 |
| Catalog Number | AG00147C(AGN-PC-0WD346) |
| Chemical Name | 3-Quinolinamine, 5-bromo- |
| IUPAC Name | 5-bromoquinolin-3-amine |
| InChI | InChI=1S/C9H7BrN2/c10-8-2-1-3-9-7(8)4-6(11)5-12-9/h1-5H,11H2 |
| InChI Key | OVPSXXBKGUKLER-UHFFFAOYSA-N |
| MDL Number | MFCD19981984 |
| Molecular Formula | C9H7BrN2 |
| Molecular Weight | 223.0693 |
| SMILES | NC1=CC2=C(Br)C=CC=C2N=C1 |
| Synonyms | 5-Bromoquinolin-3-amine,
1330754-37-4,
3-Quinolinamine, 5-bromo-,
DTXSID60856848,
MFCD19981984,
ZINC72207309,
AKOS022173576,
FCH1362431,
AK138115,
AS-41402,
SC-68173,
AJ-120674,
AX8259664,
ST24044558,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.073g/mol |
| Monoisotopic Mass | 221.979g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 38.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number