1228182-52-2
DIMETHACHLOR METABOLITE SYN 528702 SODIUM SALT
Name
DIMETHACHLOR METABOLITE SYN 528702 SODIUM SALT
Formula
C15 H20 N O5 S . Na
MolWeight
349.381
1Identification
【Name】
DIMETHACHLOR METABOLITE SYN 528702 SODIUM SALT
【CAS】
【MDL】
MFCD16652582
【English Synonyms】
【Formula】
C15 H20 N O5 S . Na
【MolWeight】
349.381
【Inchi】
InChI=1S/C15H21NO5S.Na/c1-10-4-3-5-11(2)14(10)16(13(19)8-17)6-7-22-9-12(18)15(20)21;/h3-5,12,17-18H,6-9H2,1-2H3,(H,20,21);/q;+1/p-1
【InChIKey】
InChIKey=AVSNXORCABRXGJ-UHFFFAOYSA-M
【SMILES】
Cc1cccc(c1N(CCSCC(C(=O)[O-])O)C(=O)CO)C.[Na+]
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIMETHACHLOR METABOLITE SYN 528702 SODIUM SALT.cml
Quick Release
N,N-DIMETHYL-3-((2-[(METHYLAMINO)METHYL]PYRIDIN-4-YL)OXY)ANILINE
([6-(OXOLAN-3-YLMETHOXY)PYRIDIN-2-YL]METHYL)(PROPYL)AMINE
[5-(OXOLAN-3-YLMETHOXY)-2-(PROPAN-2-YL)PYRIMIDIN-4-YL]METHANAMINE
(2-METHYLPROPYL)(([2-(OXOLAN-3-YLMETHOXY)PYRIDIN-3-YL]METHYL))AMINE
([3-CHLORO-6-(OXOLAN-3-YLMETHOXY)PYRIDIN-2-YL]METHYL)(METHYL)AMINE
([5-CHLORO-6-(OXOLAN-3-YLMETHOXY)PYRIDIN-3-YL]METHYL)(PROPYL)AMINE
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