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1,1-Dimethyl-4-phenylpiperazinium Iodide

Catalog Number
ACM54773-1
Product Name
1,1-Dimethyl-4-phenylpiperazinium Iodide
Structure
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CAS
54-77-3
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Synonyms
DMPP iodide; ANW-32189; CHEMBL47814; SMR000058572; KS-000012Q8; C-45761; AX8052430; 1,1-dimethyl-4-phenylpiperazine, iodide; MLS000069397; NC00315;
IUPAC Name
1,1-dimethyl-4-phenylpiperazin-1-ium;iodide;
Molecular Weight
318.202g/mol
Molecular Formula
C12H19IN2;
Canonical SMILES
C[N+]1(CCN(CC1)C2=CC=CC=C2)C.[I-];
InChI
InChI=1S/C12H19N2.HI/c1-14(2)10-8-13(9-11-14)12-6-4-3-5-7-12;/h3-7H,8-11H2,1-2H3;1H/q+1;/p-1;
InChI Key
XFZJGFIKQCCLGK-UHFFFAOYSA-M;
Storage
-20°C
Complexity
173
Covalently-Bonded Unit Count
2
EC Number
200-213-0
Exact Mass
318.059g/mol
H-Bond Acceptor
2
Heavy Atom Count
15
Monoisotopic Mass
318.059g/mol
NSC Number
89754
Rotatable Bond Count
1
Topological Polar Surface Area
3.2A^2
UNII
X95H7DRX99
Application
1,1-Dimethyl-4-phenylpiperazinium iodide, a white fine crystalline powder, serves as a nicotinic acetylcholine receptor agonist and acts as a nitrification inhibitor. Its primary purpose is to enhance fertilizer nitrogen use efficiency (NUE), potentially leading to more effective agricultural practices.
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