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Home > Bromides > 1282516-69-1
1282516-69-1 | Imidazo[1,2-d][1,4]benzoxazepine, 9-bromo-5,6-dihydro-2-iodo-
CAS No: 1282516-69-1 Catalog No: AG000XWC MDL No:MFCD22690733
Product Description
Catalog Number:
AG000XWC
Chemical Name:
Imidazo[1,2-d][1,4]benzoxazepine, 9-bromo-5,6-dihydro-2-iodo-
CAS Number:
1282516-69-1
Molecular Formula:
C11H8BrIN2O
Molecular Weight:
391.0025
MDL Number:
MFCD22690733
IUPAC Name:
9-bromo-2-iodo-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine
InChI:
InChI=1S/C11H8BrIN2O/c12-7-1-2-8-9(5-7)16-4-3-15-6-10(13)14-11(8)15/h1-2,5-6H,3-4H2
InChI Key:
SMHDMAYAZJZZHS-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)OCCn1c2nc(c1)I
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
389.886g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
391.006g/mol
Monoisotopic Mass:
389.886g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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