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1810074-61-3 | 2H-1-Benzopyran-4-amine, 3,4-dihydro-6-(trifluoromethoxy)-, hydrochloride (1:1), (4R)-
CAS No: 1810074-61-3 Catalog No: AG0022KR MDL No:MFCD24436051
Product Description
Catalog Number:
AG0022KR
Chemical Name:
2H-1-Benzopyran-4-amine, 3,4-dihydro-6-(trifluoromethoxy)-, hydrochloride (1:1), (4R)-
CAS Number:
1810074-61-3
Molecular Formula:
C10H11ClF3NO2
Molecular Weight:
269.6480
MDL Number:
MFCD24436051
IUPAC Name:
(4R)-6-(trifluoromethoxy)-3,4-dihydro-2H-chromen-4-amine;hydrochloride
InChI:
InChI=1S/C10H10F3NO2.ClH/c11-10(12,13)16-6-1-2-9-7(5-6)8(14)3-4-15-9;/h1-2,5,8H,3-4,14H2;1H/t8-;/m1./s1
InChI Key:
BLYCHOGTNJQXPK-DDWIOCJRSA-N
SMILES:
N[C@@H]1CCOc2c1cc(cc2)OC(F)(F)F.Cl
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
269.043g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.648g/mol
Monoisotopic Mass:
269.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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