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26015-78-1

26015-78-1 | 1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2-hydroxyethyl)-

CAS No: 26015-78-1 Catalog No: AG002REL MDL No:

Product Description

Catalog Number:
AG002REL
Chemical Name:
1H-Isoindole-1,3(2H)-dione, 4,5,6,7-tetrabromo-2-(2-hydroxyethyl)-
CAS Number:
26015-78-1
Molecular Formula:
C10H5Br4NO3
Molecular Weight:
506.7676
IUPAC Name:
4,5,6,7-tetrabromo-2-(2-hydroxyethyl)isoindole-1,3-dione
InChI:
InChI=1S/C10H5Br4NO3/c11-5-3-4(6(12)8(14)7(5)13)10(18)15(1-2-16)9(3)17/h16H,1-2H2
InChI Key:
ZEEJBQJAPCTECM-UHFFFAOYSA-N
SMILES:
OCCN1C(=O)c2c(C1=O)c(Br)c(c(c2Br)Br)Br

Properties

Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
506.696g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
506.77g/mol
Monoisotopic Mass:
502.7g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  

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