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Home > Fluorides > 1713163-98-4
1713163-98-4 | 2-(2-Fluorophenyl)-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS No: 1713163-98-4 Catalog No: AG01F54U MDL No:
Product Description
Catalog Number:
AG01F54U
Chemical Name:
2-(2-Fluorophenyl)-1,3,8-triazaspiro[4.5]dec-1-en-4-one hydrochloride
CAS Number:
1713163-98-4
Molecular Formula:
C13H15ClFN3O
Molecular Weight:
283.7291
IUPAC Name:
2-(2-fluorophenyl)-1,3,8-triazaspiro[4.5]dec-1-en-4-one;hydrochloride
InChI:
InChI=1S/C13H14FN3O.ClH/c14-10-4-2-1-3-9(10)11-16-12(18)13(17-11)5-7-15-8-6-13;/h1-4,15H,5-8H2,(H,16,17,18);1H
InChI Key:
QAUKUGHWBSXPTO-UHFFFAOYSA-N
SMILES:
O=C1NC(=NC21CCNCC2)c1ccccc1F.Cl
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.089g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
283.731g/mol
Monoisotopic Mass:
283.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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