Home Halogens 3-bromoquinoline-2-carboxylic acid

3-bromoquinoline-2-carboxylic acid

CAS No.:
1564924-85-1
Catalog Number:
AG01BBQC
Molecular Formula:
C10H6BrNO2
Molecular Weight:
252.0641
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Product Description
Catalog Number:
AG01BBQC
Chemical Name:
3-bromoquinoline-2-carboxylic acid
CAS Number:
1564924-85-1
Molecular Formula:
C10H6BrNO2
Molecular Weight:
252.0641
MDL Number:
MFCD26050797
IUPAC Name:
3-bromoquinoline-2-carboxylic acid
InChI:
InChI=1S/C10H6BrNO2/c11-7-5-6-3-1-2-4-8(6)12-9(7)10(13)14/h1-5H,(H,13,14)
InChI Key:
CWLWJWAETQLUHB-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc2ccccc2cc1Br
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.958g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
252.067g/mol
Monoisotopic Mass:
250.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties