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Home > Fluorides > 1151397-80-6
1151397-80-6 | 2H-1-Benzazepin-2-one, 9-fluoro-1,3,4,5-tetrahydro-
CAS No: 1151397-80-6 Catalog No: AG000GB1 MDL No:MFCD14584723
Product Description
Catalog Number:
AG000GB1
Chemical Name:
2H-1-Benzazepin-2-one, 9-fluoro-1,3,4,5-tetrahydro-
CAS Number:
1151397-80-6
Molecular Formula:
C10H10FNO
Molecular Weight:
179.1909
MDL Number:
MFCD14584723
IUPAC Name:
9-fluoro-1,3,4,5-tetrahydro-1-benzazepin-2-one
InChI:
InChI=1S/C10H10FNO/c11-8-5-1-3-7-4-2-6-9(13)12-10(7)8/h1,3,5H,2,4,6H2,(H,12,13)
InChI Key:
KMYVMVIUWUEBAT-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c(N1)c(F)ccc2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.075g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.194g/mol
Monoisotopic Mass:
179.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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