| CAS Number | 603951-41-3 |
| Catalog Number | AG019X4I(AGN-PC-0WODRT) |
| Chemical Name | 1-(5-Methylthiophen-2-yl)ethan-1-amine |
| IUPAC Name | 1-(5-methylthiophen-2-yl)ethanamine |
| InChI | InChI=1S/C7H11NS/c1-5-3-4-7(9-5)6(2)8/h3-4,6H,8H2,1-2H3 |
| InChI Key | CODYMUAFGSPBNA-UHFFFAOYSA-N |
| MDL Number | MFCD05215239 |
| Molecular Formula | C7H11NS |
| Molecular Weight | 141.2339 |
| SMILES | CC(C1SC(C)=CC=1)N |
| Synonyms | 1-(5-methylthiophen-2-yl)ethan-1-amine,
603951-41-3,
1-(5-methylthiophen-2-yl)ethanamine,
2-Thiophenemethanamine, alpha,5-dimethyl-,
AC1N7HNN,
AC1Q2B7W,
SCHEMBL506526,
CTK6C0049,
CODYMUAFGSPBNA-UHFFFAOYSA-N,
AKOS000123589,
AKOS016900686,
MCULE-3421947079,
NE54109,
(+/-)-2-(1-Aminoethyl)-5-methylthiophene,
EN300-54022,
1-(5-methyl-thiophen-2-yl)-ethylamine, AldrichCPR,
CID4279427,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.232g/mol |
| Monoisotopic Mass | 141.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number