Home Carboxys 7-Bromo-2-methyl-1-propyl-1,3-benzodiazole-5-carboxylic acid

7-Bromo-2-methyl-1-propyl-1,3-benzodiazole-5-carboxylic acid

CAS No.:
1437794-80-3
Catalog Number:
AG00AQHP
Molecular Formula:
C12H13BrN2O2
Molecular Weight:
297.1478
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$150
- +
5g
97%
In Stock USA
United States
$450
- +
10g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00AQHP
Chemical Name:
7-Bromo-2-methyl-1-propyl-1,3-benzodiazole-5-carboxylic acid
CAS Number:
1437794-80-3
Molecular Formula:
C12H13BrN2O2
Molecular Weight:
297.1478
MDL Number:
MFCD24448850
IUPAC Name:
7-bromo-2-methyl-1-propylbenzimidazole-5-carboxylic acid
InChI:
InChI=1S/C12H13BrN2O2/c1-3-4-15-7(2)14-10-6-8(12(16)17)5-9(13)11(10)15/h5-6H,3-4H2,1-2H3,(H,16,17)
InChI Key:
SMQSAXPZTOZSAW-UHFFFAOYSA-N
SMILES:
CCCn1c(C)nc2c1c(Br)cc(c2)C(=O)O
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.016g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
297.152g/mol
Monoisotopic Mass:
296.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties