| CAS Number | 106024-58-2 |
| Catalog Number | AG00J2YJ(AGN-PC-0NW9QH) |
| Chemical Name | (1H-Indol-2-yl)methanamine oxalate |
| IUPAC Name | 1H-indol-2-ylmethanamine;oxalic acid |
| InChI | InChI=1S/C9H10N2.C2H2O4/c10-6-8-5-7-3-1-2-4-9(7)11-8;3-1(4)2(5)6/h1-5,11H,6,10H2;(H,3,4)(H,5,6) |
| InChI Key | KDJIUYHNTDDXKW-UHFFFAOYSA-N |
| MDL Number | MFCD07368299 |
| Molecular Formula | C11H12N2O4 |
| Molecular Weight | 236.2240 |
| SMILES | N1C2=CC=CC=C2C=C1CN.C(O)(=O)C(O)=O |
| Synonyms | (1H-Indol-2-ylmethyl)amine oxalate,
106024-58-2,
(1H-Indol-2-yl)methanamine oxalate,
ZX-CM010905,
MFCD07781055,
n,n-dimethyl-2-(4-piperidinyl)-1-ethanamine dihydrochloride,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 236.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.227g/mol |
| Monoisotopic Mass | 236.08g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 116A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number