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Home Carboxys Ethyl 1-butyl-1,3-benzodiazole-5-carboxylate

Ethyl 1-butyl-1,3-benzodiazole-5-carboxylate

CAS No.:
1845713-79-2
Catalog Number:
AG00I1I6
Molecular Formula:
C14H18N2O2
Molecular Weight:
246.3049
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00I1I6
Chemical Name:
Ethyl 1-butyl-1,3-benzodiazole-5-carboxylate
CAS Number:
1845713-79-2
Molecular Formula:
C14H18N2O2
Molecular Weight:
246.3049
MDL Number:
MFCD28962779
IUPAC Name:
ethyl 1-butylbenzimidazole-5-carboxylate
InChI:
InChI=1S/C14H18N2O2/c1-3-5-8-16-10-15-12-9-11(6-7-13(12)16)14(17)18-4-2/h6-7,9-10H,3-5,8H2,1-2H3
InChI Key:
ZPRNYXHAECWWEB-UHFFFAOYSA-N
SMILES:
CCCCn1cnc2c1ccc(c2)C(=O)OCC
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.137g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.31g/mol
Monoisotopic Mass:
246.137g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties