| CAS Number | 887582-19-6 |
| Catalog Number | AG004BYU(AGN-PC-05EXOG) |
| Chemical Name | (6-Fluoro-1H-indol-3-yl)methanamine |
| IUPAC Name | (6-fluoro-1H-indol-3-yl)methanamine |
| InChI | InChI=1S/C9H9FN2/c10-7-1-2-8-6(4-11)5-12-9(8)3-7/h1-3,5,12H,4,11H2 |
| InChI Key | DQJPBEARKIUNRG-UHFFFAOYSA-N |
| MDL Number | MFCD06657116 |
| Molecular Formula | C9H9FN2 |
| Molecular Weight | 164.1796 |
| SMILES | NCC1C2=C(C=C(C=C2)F)NC=1 |
| Synonyms | (6-Fluoro-1H-indol-3-yl)methanamine,
887582-19-6,
6-FLUORO-1H-INDOL-3-METHYLAMINE,
CTK5G1498,
DTXSID30651645,
1H-Indole-3-methanamine,6-fluoro-,
4596AC,
ZINC20269171,
AKOS006295101,
1-(6-Fluoro-1H-indol-3-yl)methanamine,
AJ-76724,
AK112133,
AS-55122,
SC-55447,
ST2408074,
Z-2981,
C9H9FN2,
|
| Complexity | 163 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.183g/mol |
| Monoisotopic Mass | 164.075g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 41.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P280-P305+P351+P338-P310
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UN Code
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Certificate of Analysis
Lot Number