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(3S)-6-(trifluoromethyl)-2,3-dihydro-1-benzofuran-3-amine hydrochloride

(3S)-6-(trifluoromethyl)-2,3-dihydro-1-benzofuran-3-amine hydrochloride

CAS: 2682097-48-7

Formula: C9H9ClF3NO

SMILES: Cl.N[C@@H]1COC2=C1C=CC(=C2)C(F)(F)F

IUPAC: (3S)-6-(trifluoromethyl)-2,3-dihydro-1-benzofuran-3-amine hydrochloride

InChI: InChI=1S/C9H8F3NO.ClH/c10-9(11,12)5-1-2-6-7(13)4-14-8(6)3-5;/h1-3,7H,4,13H2;1H/t7-;/m1./s1

Composition: C (45.11%), H (3.79%), Cl (14.79%), F (23.79%), N (5.85%), O (6.68%)

Molar Mass: 239.62

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 239.0324761
Formal Charge 0
FSP3 0.33
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey JINLBZDBEILIML-OGFXRTJISA-N
Lipinski's Rule of Five 1
Molar Refractivity 44.67
Topological Polar Surface Area 35.25
Polarizability 16.67
Ring Count 2
Rotatable Bond Count 1

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