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1029720-65-7

1029720-65-7 | 7-Bromo-3-chloroisoquinoline

CAS No: 1029720-65-7 Catalog No: AG0038A2 MDL No:MFCD11044699

Product Description

Catalog Number:
AG0038A2
Chemical Name:
7-Bromo-3-chloroisoquinoline
CAS Number:
1029720-65-7
Molecular Formula:
C9H5BrClN
Molecular Weight:
242.4997
MDL Number:
MFCD11044699
IUPAC Name:
7-bromo-3-chloroisoquinoline
InChI:
InChI=1S/C9H5BrClN/c10-8-2-1-6-4-9(11)12-5-7(6)3-8/h1-5H
InChI Key:
GPICPAIKTJPYEE-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)cnc(c2)Cl

Properties

Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.929g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.5g/mol
Monoisotopic Mass:
240.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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