Home Carboxys Methyl 1-butyl-2-methyl-1,3-benzodiazole-5-carboxylate

Methyl 1-butyl-2-methyl-1,3-benzodiazole-5-carboxylate

CAS No.:
1390621-30-3
Catalog Number:
AG009WT6
Molecular Formula:
C14H18N2O2
Molecular Weight:
246.3049
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$225
- +
5g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG009WT6
Chemical Name:
Methyl 1-butyl-2-methyl-1,3-benzodiazole-5-carboxylate
CAS Number:
1390621-30-3
Molecular Formula:
C14H18N2O2
Molecular Weight:
246.3049
MDL Number:
MFCD22586700
IUPAC Name:
methyl 1-butyl-2-methylbenzimidazole-5-carboxylate
InChI:
InChI=1S/C14H18N2O2/c1-4-5-8-16-10(2)15-12-9-11(14(17)18-3)6-7-13(12)16/h6-7,9H,4-5,8H2,1-3H3
InChI Key:
LDLPBTPRVZISRM-UHFFFAOYSA-N
SMILES:
CCCCn1c(C)nc2c1ccc(c2)C(=O)OC
Properties
Complexity:
296  
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:
5  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties