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159925-41-4

159925-41-4 | Quinoline, 8-bromo-6-(1-methylethyl)-

CAS No: 159925-41-4 Catalog No: AG001RIZ MDL No:MFCD25959619

Product Description

Catalog Number:
AG001RIZ
Chemical Name:
Quinoline, 8-bromo-6-(1-methylethyl)-
CAS Number:
159925-41-4
Molecular Formula:
C12H12BrN
Molecular Weight:
250.1344
MDL Number:
MFCD25959619
IUPAC Name:
8-bromo-6-propan-2-ylquinoline
InChI:
InChI=1S/C12H12BrN/c1-8(2)10-6-9-4-3-5-14-12(9)11(13)7-10/h3-8H,1-2H3
InChI Key:
BOCLLRYLXAGRDJ-UHFFFAOYSA-N
SMILES:
CC(c1cc(Br)c2c(c1)cccn2)C

Properties

Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.139g/mol
Monoisotopic Mass:
249.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  

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