| CAS Number | 86188-25-2 |
| Catalog Number | AG00IDY8(AGN-PC-0V2V63) |
| Chemical Name | [1-Methyl-2-(3-thienyl)ethyl]amine hydrochloride |
| IUPAC Name | 1-thiophen-3-ylpropan-2-amine;hydrochloride |
| InChI | InChI=1S/C7H11NS.ClH/c1-6(8)4-7-2-3-9-5-7;/h2-3,5-6H,4,8H2,1H3;1H |
| InChI Key | APYLFJHNGXXQRI-UHFFFAOYSA-N |
| MDL Number | MFCD13186055 |
| Molecular Formula | C7H12ClNS |
| Molecular Weight | 177.6949 |
| SMILES | Cl.S1C=C(C=C1)CC(C)N |
| Synonyms | 86188-25-2,
1-(THIOPHEN-3-YL)PROPAN-2-AMINE HCL,
1-(Thiophen-3-yl)propan-2-amine hydrochloride,
[1-Methyl-2-(3-thienyl)ethyl]amine hydrochloride,
(R)-1-(Thiophen-3-yl)propan-2-amine hydrochloride,
(S)-1-(Thiophen-3-yl)propan-2-amine hydrochloride,
SCHEMBL9433817,
ZX-CM002386,
AKOS027426937,
AS-43269,
3-Thiopheneethanamine, a-methyl-, hydrochloride,
N/A,
|
| Complexity | 85 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 177.037898g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 177.7g/mol |
| Monoisotopic Mass | 177.037898g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 54.3Ų |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number