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1889841-88-6

1889841-88-6 | 4,6-dibromoisoquinoline

CAS No: 1889841-88-6 Catalog No: AG01EIOC MDL No:MFCD31617331

Product Description

Catalog Number:
AG01EIOC
Chemical Name:
4,6-dibromoisoquinoline
CAS Number:
1889841-88-6
Molecular Formula:
C9H5Br2N
Molecular Weight:
286.9507
MDL Number:
MFCD31617331
IUPAC Name:
4,6-dibromoisoquinoline
InChI:
InChI=1S/C9H5Br2N/c10-7-2-1-6-4-12-5-9(11)8(6)3-7/h1-5H
InChI Key:
WLXBEBYSRQOBKV-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c(Br)cnc2

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.877g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.954g/mol
Monoisotopic Mass:
284.879g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

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