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Home > Fluorides > 717858-96-3
717858-96-3 | N-(3-Morpholin-4-yl-propyl)-3-trifluoromethyl-benzamide
CAS No: 717858-96-3 Catalog No: AG01F7UD MDL No:MFCD06004306
Product Description
Catalog Number:
AG01F7UD
Chemical Name:
N-(3-Morpholin-4-yl-propyl)-3-trifluoromethyl-benzamide
CAS Number:
717858-96-3
Molecular Formula:
C15H19F3N2O2
Molecular Weight:
316.3188
MDL Number:
MFCD06004306
IUPAC Name:
N-(3-morpholin-4-ylpropyl)-3-(trifluoromethyl)benzamide
InChI:
InChI=1S/C15H19F3N2O2/c16-15(17,18)13-4-1-3-12(11-13)14(21)19-5-2-6-20-7-9-22-10-8-20/h1,3-4,11H,2,5-10H2,(H,19,21)
InChI Key:
ITTWDAPRZKRLHA-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)C(F)(F)F)NCCCN1CCOCC1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.14g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.324g/mol
Monoisotopic Mass:
316.14g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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