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1004-95-1

1004-95-1 | Quinolizinium, bromide (1:1)

CAS No: 1004-95-1 Catalog No: AG0001WJ MDL No:

Product Description

Catalog Number:
AG0001WJ
Chemical Name:
Quinolizinium, bromide (1:1)
CAS Number:
1004-95-1
Molecular Formula:
C9H8BrN
Molecular Weight:
210.0705
IUPAC Name:
quinolizin-5-ium;bromide
InChI:
InChI=1S/C9H8N.BrH/c1-3-7-10-8-4-2-6-9(10)5-1;/h1-8H;1H/q+1;/p-1
InChI Key:
VKQSJVGUTKKLAD-UHFFFAOYSA-M
SMILES:
c1ccc2[n+](c1)cccc2.[Br-]

Properties

Complexity:
99.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.984g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.074g/mol
Monoisotopic Mass:
208.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
4.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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