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1269293-40-4

1269293-40-4 | 2H-1-Benzazepin-2-one, 9-bromo-1,3,4,5-tetrahydro-

CAS No: 1269293-40-4 Catalog No: AG000WDC MDL No:

Product Description

Catalog Number:
AG000WDC
Chemical Name:
2H-1-Benzazepin-2-one, 9-bromo-1,3,4,5-tetrahydro-
CAS Number:
1269293-40-4
Molecular Formula:
C10H10BrNO
Molecular Weight:
240.0965
IUPAC Name:
9-bromo-1,3,4,5-tetrahydro-1-benzazepin-2-one
InChI:
InChI=1S/C10H10BrNO/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:
XJCNUZDRXQVXDS-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c(N1)c(Br)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:
238.995g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
240.1g/mol
Monoisotopic Mass:
238.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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