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Home Halogens Ethyl 7-bromo-1-propyl-1,2,3-benzotriazole-5-carboxylate

Ethyl 7-bromo-1-propyl-1,2,3-benzotriazole-5-carboxylate

CAS No.:
1820686-19-8
Catalog Number:
AG00I0UU
Molecular Formula:
C12H14BrN3O2
Molecular Weight:
312.1625
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$100
- +
5g
95%
In Stock USA
United States
$300
- +
10g
95%
In Stock USA
United States
$525
- +
25g
95%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00I0UU
Chemical Name:
Ethyl 7-bromo-1-propyl-1,2,3-benzotriazole-5-carboxylate
CAS Number:
1820686-19-8
Molecular Formula:
C12H14BrN3O2
Molecular Weight:
312.1625
MDL Number:
MFCD25953934
IUPAC Name:
ethyl 7-bromo-1-propylbenzotriazole-5-carboxylate
InChI:
InChI=1S/C12H14BrN3O2/c1-3-5-16-11-9(13)6-8(12(17)18-4-2)7-10(11)14-15-16/h6-7H,3-5H2,1-2H3
InChI Key:
CNUXEFRDQCKJNS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(Br)c2c(c1)nnn2CCC
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.027g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.167g/mol
Monoisotopic Mass:
311.027g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties