Home Other Building Blocks ethyl 2-(5,6-dimethyl-1H-1,3-benzodiazol-2-yl)acetate

ethyl 2-(5,6-dimethyl-1H-1,3-benzodiazol-2-yl)acetate

CAS No.:
2148-86-9
Catalog Number:
AG019ZLH
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
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Product Description
Catalog Number:
AG019ZLH
Chemical Name:
ethyl 2-(5,6-dimethyl-1H-1,3-benzodiazol-2-yl)acetate
CAS Number:
2148-86-9
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
MDL Number:
MFCD22375245
IUPAC Name:
ethyl 2-(5,6-dimethyl-1H-benzimidazol-2-yl)acetate
InChI:
InChI=1S/C13H16N2O2/c1-4-17-13(16)7-12-14-10-5-8(2)9(3)6-11(10)15-12/h5-6H,4,7H2,1-3H3,(H,14,15)
InChI Key:
HJEFOTGDLMGZFW-UHFFFAOYSA-N
SMILES:
CCOC(=O)Cc1[nH]c2c(n1)cc(c(c2)C)C
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties