| CAS Number | 59609-63-1 |
| Catalog Number | AG00ECSD(AGN-PC-00M89G) |
| Chemical Name | 6-Bromo-N,N-dimethyl-1H-indole-3-methanamine |
| IUPAC Name | 1-(6-bromo-1H-indol-3-yl)-N,N-dimethylmethanamine |
| InChI | InChI=1S/C11H13BrN2/c1-14(2)7-8-6-13-11-5-9(12)3-4-10(8)11/h3-6,13H,7H2,1-2H3 |
| InChI Key | CKUNQRCQLWHINE-UHFFFAOYSA-N |
| MDL Number | MFCD11048384 |
| Molecular Formula | C11H13BrN2 |
| Molecular Weight | 253.1383 |
| SMILES | CN(Cc1c[nH]c2c1ccc(c2)Br)C |
| Synonyms | 6-Bromogramine,
59609-63-1,
1-(6-Bromo-1H-indol-3-yl)-N,N-dimethylmethanamine,
Q-102649,
1H-Indole-3-methanamine, 6-bromo-N,N-dimethyl-,
SCHEMBL6031494,
CKUNQRCQLWHINE-UHFFFAOYSA-N,
ZINC35635660,
AKOS024115363,
CB-1177,
FCH1402095,
6-Bromo-N,N-dimethyl-1H-indole-3-methanamine,
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| Complexity | 196 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.143g/mol |
| Monoisotopic Mass | 252.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 19A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number