5-EAPB Hydrochloride - CAS 1823776-22-2
Catalog: |
BB055009 |
Product Name: |
5-EAPB Hydrochloride |
CAS: |
1823776-22-2 |
Synonyms: |
5-Eapb hydrochloride; 5-EAPBHydrochloride; 5-EAPB (hydrochloride); 1-(Benzofuran-5-yl)-N-ethylpropan-2-amine hydrochloride; 1-(1-benzofuran-5-yl)-N-ethylpropan-2-amine; hydrochloride; 5-EAPB HCl |
IUPAC Name: | 1-(1-benzofuran-5-yl)-N-ethylpropan-2-aminehydrochloride |
Molecular Weight: | 239.74 |
Molecular Formula: | C13H18ClNO |
Canonical SMILES: | CCNC(C)CC1=CC2=C(C=C1)OC=C2.Cl |
InChI: | InChI=1S/C13H17NO.ClH/c1-3-14-10(2)8-11-4-5-13-12(9-11)6-7-15-13/h4-7,9-10,14H,3,8H2,1-2H31H |
InChI Key: | YJEXOIDIYJUVNS-UHFFFAOYSA-N |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.1076919 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.1076919 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 25.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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