Home Other Building Blocks 2-CYANO-3-BROMOQUINOLINE

2-CYANO-3-BROMOQUINOLINE

CAS No.:
61830-11-3
Catalog Number:
AG00EG4P
Molecular Formula:
C10H5BrN2
Molecular Weight:
233.0641
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Product Description
Catalog Number:
AG00EG4P
Chemical Name:
2-CYANO-3-BROMOQUINOLINE
CAS Number:
61830-11-3
Molecular Formula:
C10H5BrN2
Molecular Weight:
233.0641
MDL Number:
MFCD08705682
IUPAC Name:
3-bromoquinoline-2-carbonitrile
InChI:
InChI=1S/C10H5BrN2/c11-8-5-7-3-1-2-4-9(7)13-10(8)6-12/h1-5H
InChI Key:
HBLOASAMGUFRQN-UHFFFAOYSA-N
SMILES:
N#Cc1nc2ccccc2cc1Br
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.964g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.068g/mol
Monoisotopic Mass:
231.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties