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140700-64-7 | 2H-1-Benzazepin-2-one, 1,3,4,5-tetrahydro-3-iodo-
CAS No: 140700-64-7 Catalog No: AG001CPY MDL No:
Product Description
Catalog Number:
AG001CPY
Chemical Name:
2H-1-Benzazepin-2-one, 1,3,4,5-tetrahydro-3-iodo-
CAS Number:
140700-64-7
Molecular Formula:
C10H10INO
Molecular Weight:
287.0970
IUPAC Name:
3-iodo-1-benzazepin-2-one
InChI:
InChI=1S/C10H6INO/c11-8-6-5-7-3-1-2-4-9(7)12-10(8)13/h1-6H
InChI Key:
AYCLFURWELXWML-UHFFFAOYSA-N
SMILES:
O=C1Nc2ccccc2CCC1I
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.949g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.068g/mol
Monoisotopic Mass:
282.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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