Home Halogens 5-bromo-1-methylpyrrole-2-carboxylic acid

5-bromo-1-methylpyrrole-2-carboxylic acid

CAS No.:
865186-82-9
Catalog Number:
AG0036F6
Molecular Formula:
C6H6BrNO2
Molecular Weight:
204.0213
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$223
- +
Product Description
Catalog Number:
AG0036F6
Chemical Name:
5-bromo-1-methylpyrrole-2-carboxylic acid
CAS Number:
865186-82-9
Molecular Formula:
C6H6BrNO2
Molecular Weight:
204.0213
MDL Number:
MFCD16659627
IUPAC Name:
5-bromo-1-methylpyrrole-2-carboxylic acid
InChI:
InChI=1S/C6H6BrNO2/c1-8-4(6(9)10)2-3-5(8)7/h2-3H,1H3,(H,9,10)
InChI Key:
PKYXJNNPHVMPDQ-UHFFFAOYSA-N
SMILES:
Cn1c(ccc1Br)C(=O)O
Properties
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.958g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
204.023g/mol
Monoisotopic Mass:
202.958g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties