Home Halogens 5-bromo-2-cyclopropylpyridine-3-carboxylic acid

5-bromo-2-cyclopropylpyridine-3-carboxylic acid

CAS No.:
1601026-05-4
Catalog Number:
AG01BJAW
Molecular Formula:
C9H8BrNO2
Molecular Weight:
242.0693
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Product Description
Catalog Number:
AG01BJAW
Chemical Name:
5-bromo-2-cyclopropylpyridine-3-carboxylic acid
CAS Number:
1601026-05-4
Molecular Formula:
C9H8BrNO2
Molecular Weight:
242.0693
MDL Number:
MFCD30752502
IUPAC Name:
5-bromo-2-cyclopropylpyridine-3-carboxylic acid
InChI:
InChI=1S/C9H8BrNO2/c10-6-3-7(9(12)13)8(11-4-6)5-1-2-5/h3-5H,1-2H2,(H,12,13)
InChI Key:
XULICKGKHMOJFD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(Br)cnc1C1CC1
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
242.072g/mol
Monoisotopic Mass:
240.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties