Home Other Building Blocks 1-(2-ethyl-5-methyl-2H-1,2,3-triazol-4-yl)ethan-1-one

1-(2-ethyl-5-methyl-2H-1,2,3-triazol-4-yl)ethan-1-one

CAS No.:
1934906-01-0
Catalog Number:
AG01AN6N
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
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Product Description
Catalog Number:
AG01AN6N
Chemical Name:
1-(2-ethyl-5-methyl-2H-1,2,3-triazol-4-yl)ethan-1-one
CAS Number:
1934906-01-0
Molecular Formula:
C7H11N3O
Molecular Weight:
153.1817
MDL Number:
MFCD30730402
IUPAC Name:
1-(2-ethyl-5-methyltriazol-4-yl)ethanone
InChI:
InChI=1S/C7H11N3O/c1-4-10-8-5(2)7(9-10)6(3)11/h4H2,1-3H3
InChI Key:
GOBGVGBEMRSDFM-UHFFFAOYSA-N
SMILES:
CCn1nc(c(n1)C(=O)C)C
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.09g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.185g/mol
Monoisotopic Mass:
153.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
47.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties