Home Halogens [5-(2,4-Dichloro-phenyl)-4h-[1,2,4]triazol-3-ylsulfanyl]-acetic acid

[5-(2,4-Dichloro-phenyl)-4h-[1,2,4]triazol-3-ylsulfanyl]-acetic acid

CAS No.:
18378-68-2
Catalog Number:
AG00I1FI
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00I1FI
Chemical Name:
[5-(2,4-Dichloro-phenyl)-4h-[1,2,4]triazol-3-ylsulfanyl]-acetic acid
CAS Number:
18378-68-2
MDL Number:
MFCD00763768
IUPAC Name:
2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid
InChI:
InChI=1S/C10H7Cl2N3O2S/c11-5-1-2-6(7(12)3-5)9-13-10(15-14-9)18-4-8(16)17/h1-3H,4H2,(H,16,17)(H,13,14,15)
InChI Key:
FZAXATWDNNEIQC-UHFFFAOYSA-N
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.964g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
304.145g/mol
Monoisotopic Mass:
302.964g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties