3-[3-(Trifluoromethyl)phenyl]propan-1-amine Hydrochloride - CAS 104774-93-8
Catalog: |
BB057217 |
Product Name: |
3-[3-(Trifluoromethyl)phenyl]propan-1-amine Hydrochloride |
CAS: |
104774-93-8 |
Synonyms: |
3-[3-(trifluoromethyl)phenyl]propan-1-amine hydrochloride; 3-[3-(trifluoromethyl)phenyl]propan-1-amine; hydrochloride |
IUPAC Name: | 3-[3-(trifluoromethyl)phenyl]propan-1-aminehydrochloride |
Description: | 3-[3-(trifluoromethyl)phenyl]propan-1-amine hydrochloride (cas# 104774-93-8) is a useful research chemical. |
Molecular Weight: | 239.66 |
Molecular Formula: | C10H12NF3·HCl |
Canonical SMILES: | C1=CC(=CC(=C1)C(F)(F)F)CCCN.Cl |
InChI: | InChI=1S/C10H12F3N.ClH/c11-10(12,13)9-5-1-3-8(7-9)4-2-6-14/h1,3,5,7H,2,4,6,14H21H |
InChI Key: | NILRPDXPEDEDEI-UHFFFAOYSA-N |
Complexity: | 167 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.0688616 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.0688616 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 26Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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