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Home > Bromides > 1401305-33-6
1401305-33-6 | Imidazo[1,2-d][1,4]benzoxazepine, 10-bromo-5,6-dihydro-2-iodo-9-methyl-
CAS No: 1401305-33-6 Catalog No: AG001C1R MDL No:MFCD22581528
Product Description
Catalog Number:
AG001C1R
Chemical Name:
Imidazo[1,2-d][1,4]benzoxazepine, 10-bromo-5,6-dihydro-2-iodo-9-methyl-
CAS Number:
1401305-33-6
Molecular Formula:
C12H10BrIN2O
Molecular Weight:
405.0291
MDL Number:
MFCD22581528
IUPAC Name:
10-bromo-2-iodo-9-methyl-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepine
InChI:
InChI=1S/C12H10BrIN2O/c1-7-4-10-8(5-9(7)13)12-15-11(14)6-16(12)2-3-17-10/h4-6H,2-3H2,1H3
InChI Key:
DLJKTEOUHDWXGN-UHFFFAOYSA-N
SMILES:
Ic1cn2c(n1)c1cc(Br)c(cc1OCC2)C
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.902g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.033g/mol
Monoisotopic Mass:
403.902g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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