1-dodecylguanidine (CHEBI:74880)

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CHEBI:74880 - 1-dodecylguanidine

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ChEBI ID	CHEBI:74880
ChEBI Name	1-dodecylguanidine
Stars
Definition	A member of the class of guanidines that is guanidine in which one of the amino groups is substituted by a dodecyl group. It is used (generally as its acetate salt, known as dodine) as a agrochemical fungicide.
Last Modified	10 July 2015
Submitter	Gareth Owen
Downloads	Molfile

Formula	C13H29N3
Net Charge	0
Average Mass	227.396
Monoisotopic Mass	227.23615
SMILES	CCCCCCCCCCCCNC(=N)N
InChI	InChI=1S/C13H29N3/c1-2-3-4-5-6-7-8-9-10-11-12-16-13(14)15/h2-12H2,1H3,(H4,14,15,16)
InChIKey	HILAYQUKKYWPJW-UHFFFAOYSA-N

Roles Classification

Biological Roles:	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
Application:	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties.

ChEBI Ontology

Outgoing Relation(s)
	1-dodecylguanidine (CHEBI:74880) has part dodecyl group (CHEBI:23870)
	1-dodecylguanidine (CHEBI:74880) has part guanidino group (CHEBI:48551)
	1-dodecylguanidine (CHEBI:74880) has role antibacterial agent (CHEBI:33282)
	1-dodecylguanidine (CHEBI:74880) has role antifungal agrochemical (CHEBI:86328)
	1-dodecylguanidine (CHEBI:74880) is a aliphatic nitrogen antifungal agent (CHEBI:86417)
	1-dodecylguanidine (CHEBI:74880) is a guanidines (CHEBI:24436)
	1-dodecylguanidine (CHEBI:74880) is conjugate base of 1-dodecylguanidine(1+) (CHEBI:74887)
Incoming Relation(s)
Incoming Relation(s)	1-dodecylguanidine(1+) (CHEBI:74887) is conjugate acid of 1-dodecylguanidine (CHEBI:74880)

IUPAC Name
1-dodecylguanidine

Synonyms	Source
1-laurylguanidine	ChEBI
C12-G	ChEBI
dodecylguanidine	ChemIDplus
n-dodecylguanidine	ChEBI
laurylguanidine	ChEBI

Registry Numbers	Sources
Reaxys:637515	Reaxys
CAS:112-65-2	ChemIDplus

Citations