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Home Halogens Ethyl 7-bromo-1-propyl-1,3-benzodiazole-5-carboxylate

Ethyl 7-bromo-1-propyl-1,3-benzodiazole-5-carboxylate

CAS No.:
1820666-72-5
Catalog Number:
AG00I0QP
Molecular Formula:
C13H15BrN2O2
Molecular Weight:
311.1744
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$100
- +
5g
97%
In Stock USA
United States
$300
- +
10g
97%
In Stock USA
United States
$525
- +
25g
97%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00I0QP
Chemical Name:
Ethyl 7-bromo-1-propyl-1,3-benzodiazole-5-carboxylate
CAS Number:
1820666-72-5
Molecular Formula:
C13H15BrN2O2
Molecular Weight:
311.1744
MDL Number:
MFCD25953933
IUPAC Name:
ethyl 7-bromo-1-propylbenzimidazole-5-carboxylate
InChI:
InChI=1S/C13H15BrN2O2/c1-3-5-16-8-15-11-7-9(13(17)18-4-2)6-10(14)12(11)16/h6-8H,3-5H2,1-2H3
InChI Key:
FSHRTZORWYXYAO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)c2c(c1)ncn2CCC
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
310.032g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.179g/mol
Monoisotopic Mass:
310.032g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties