| CAS Number | 1049713-35-0 |
| Catalog Number | AG00J436(AGN-PC-0WB7U8) |
| Chemical Name | N-(3-Thienylmethyl)-1-propanamine hydrochloride |
| IUPAC Name | N-(thiophen-3-ylmethyl)propan-1-amine;hydrochloride |
| InChI | InChI=1S/C8H13NS.ClH/c1-2-4-9-6-8-3-5-10-7-8;/h3,5,7,9H,2,4,6H2,1H3;1H |
| InChI Key | WEPOHXHOYGNJEP-UHFFFAOYSA-N |
| MDL Number | MFCD07170359 |
| Molecular Formula | C8H14ClNS |
| Molecular Weight | 191.7215 |
| SMILES | C1(CNCCC)C=CSC=1.Cl |
| Synonyms | 1049713-35-0,
N-(3-Thienylmethyl)-1-propanamine hydrochloride,
N-(Thiophen-3-ylmethyl)propan-1-amine hydrochloride,
ZX-CM018364,
MFCD07170359,
AKOS027386362,
MCULE-6881060157,
|
| Complexity | 85.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 191.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 191.717g/mol |
| Monoisotopic Mass | 191.054g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 40.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
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