Home Halogens 3-(2,4-dichlorophenoxymethyl)-1H-1,2,4-triazole-5-carboxamide

3-(2,4-dichlorophenoxymethyl)-1H-1,2,4-triazole-5-carboxamide

CAS No.:
400080-22-0
Catalog Number:
AG01BAI1
Molecular Formula:
C10H8Cl2N4O2
Molecular Weight:
287.1021
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Product Description
Catalog Number:
AG01BAI1
Chemical Name:
3-(2,4-dichlorophenoxymethyl)-1H-1,2,4-triazole-5-carboxamide
CAS Number:
400080-22-0
Molecular Formula:
C10H8Cl2N4O2
Molecular Weight:
287.1021
MDL Number:
MFCD01936204
IUPAC Name:
5-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-3-carboxamide
InChI:
InChI=1S/C10H8Cl2N4O2/c11-5-1-2-7(6(12)3-5)18-4-8-14-10(9(13)17)16-15-8/h1-3H,4H2,(H2,13,17)(H,14,15,16)
InChI Key:
HZRFDXVYQRQBOD-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)OCc1n[nH]c(n1)C(=O)N
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.002g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
287.1g/mol
Monoisotopic Mass:
286.002g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
93.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties