Home Halogens sodium 2,4,5-trichlorophenoxyacetate

sodium 2,4,5-trichlorophenoxyacetate

CAS No.:
13560-99-1
Catalog Number:
AG00AJAZ
Molecular Formula:
C8H4Cl3O3-
Molecular Weight:
254.4746
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Product Description
Catalog Number:
AG00AJAZ
Chemical Name:
sodium 2,4,5-trichlorophenoxyacetate
CAS Number:
13560-99-1
Molecular Formula:
C8H4Cl3O3-
Molecular Weight:
254.4746
MDL Number:
MFCD01672778
IUPAC Name:
sodium;2-(2,4,5-trichlorophenoxy)acetate
InChI:
InChI=1S/C8H5Cl3O3.Na/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13;/h1-2H,3H2,(H,12,13);/q;+1/p-1
InChI Key:
KXVMKVOQCMSZSZ-UHFFFAOYSA-M
SMILES:
[O-]C(=O)COc1cc(Cl)c(cc1Cl)Cl
EC Number:
236-949-4
UNII:
AO453154P9
UN Number:
2765
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.912g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.457g/mol
Monoisotopic Mass:
275.912g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties