| CAS Number | 1072806-66-6 |
| Catalog Number | AG00985L(AGN-PC-0WB6G1) |
| Chemical Name | 2-(Aminomethyl)-1H-indole methanesulphonate |
| IUPAC Name | 1H-indol-2-ylmethanamine;methanesulfonic acid |
| InChI | InChI=1S/C9H10N2.CH4O3S/c10-6-8-5-7-3-1-2-4-9(7)11-8;1-5(2,3)4/h1-5,11H,6,10H2;1H3,(H,2,3,4) |
| InChI Key | JTFXLRDQYSVMIU-UHFFFAOYSA-N |
| MDL Number | MFCD03756929 |
| Molecular Formula | C10H14N2O3S |
| Molecular Weight | 242.2948 |
| SMILES | S(=O)(=O)(C)O.N1C2=CC=CC=C2C=C1CN |
| Synonyms | 2-(Aminomethyl)-1H-indole methanesulphonate,
1072806-66-6,
(1H-indol-2-yl)methanamine methanesulfonate,
SCHEMBL243888,
CTK7B4544,
JTFXLRDQYSVMIU-UHFFFAOYSA-N,
1H-indol-2-ylmethanamine mesylate,
ZX-AT000428,
ZX-CM011153,
MFCD03756929,
OR5660,
AKOS024302070,
MCULE-6551089352,
2-(Aminomethyl)-1H-indole methanesulfonate,
(1H-indol-2-ylmethyl)amine methanesulfonate,
A-7069,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.073g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 242.293g/mol |
| Monoisotopic Mass | 242.073g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 105A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number