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Home > Fluorides > 114414-02-7
114414-02-7 | (+/-)-Fluoxetine-d4 oxalate
CAS No: 114414-02-7 Catalog No: AG01FO3J MDL No:
Product Description
Catalog Number:
AG01FO3J
Chemical Name:
(+/-)-Fluoxetine-d4 oxalate
CAS Number:
114414-02-7
IUPAC Name:
N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine;oxalic acid
InChI:
InChI=1S/C17H18F3NO.C2H2O4/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20;3-1(4)2(5)6/h2-10,16,21H,11-12H2,1H3;(H,3,4)(H,5,6)
InChI Key:
CKOSCBUBUNGPOY-UHFFFAOYSA-N
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
399.129g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
399.366g/mol
Monoisotopic Mass:
399.129g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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