ContaminantDB: Cyromazine

Identification Taxonomy Biological Properties Physical Properties Toxicity Profile Spectra Concentrations Links References Targets (3)XML

Record Information

Version

1.0

Creation Date

2014-08-29 06:51:41 UTC

Update Date

2026-04-15 17:27:06 UTC

Accession Number

CHEM003453

Identification

Common Name

Cyromazine

Class

Small Molecule

Description

Ectoparasiticide. Insect growth regulator. Specific activity against dipterous larvae. Cyromazine is a fda approved for use in livestock. Cyromazine belongs to the family of Aminotriazines. These are organic compounds containing an amino group attached to a triazine ring.

Contaminant Sources

FooDB Chemicals
HPV EPA Chemicals
My Exposome Chemicals
STOFF IDENT Compounds
T3DB toxins
ToxCast & Tox21 Chemicals

Contaminant Type

Amine
Food Toxin
Metabolite
Organic Compound
Pesticide
Synthetic Compound

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Value	Source
2,4-Diamino-6-(cyclopropylamino)-S-triazine	ChEBI
2-Cyclopropylamino-4,6-diamino-S-triazine	ChEBI
Cyclopropylmelamine	ChEBI
Larvadex	ChEBI
N-Cyclopropyl-1,3,5-triazine-2,4,6-triamine	ChEBI
N-Cyclopropylmelamine	ChEBI
Trigard	ChEBI
Vetrazin	ChEBI
Neporex	Kegg
2,4-Diamino-6-(cyclopropylamino)-S-triazine (8ci)	HMDB
Armor	HMDB
Azimethiphos	HMDB
CGA 72662	HMDB
Ciromazina	HMDB
Citation	HMDB
Cyclopropyl-1,3,5-triazine-2,4,6-triamine	HMDB
Cypromazine	HMDB
Cyromazin	HMDB
Cyromazinum	HMDB
Diamino-6-(cyclopropylamino)-S-triazine	HMDB
Larvadex premix	HMDB
N(2)-Cyclopropyl-1,3,5-triazine-2,4,6-triamine	HMDB
N-Cyclopropyl-1,3,5-triazin-2,4,6-triamine	HMDB
N-Cyclopropyl-1,3,5-triazine-2,4,6-triamine, 9ci	HMDB
N-Cyclopropyl-2,4,6-triamino-1,3,5-triazine	HMDB
N-Cyclopropyltriazine-2,4,6-triamine	HMDB
N2-Cyclopropyl-1,3,5-triazine-2,4,6-triamine	HMDB
Neoprex	HMDB
Vetrazin (pesticide)	HMDB
Vetrazine	HMDB
Cyromazine dihydrochloride	HMDB

Chemical Formula

C₆H₁₀N₆

Average Molecular Mass

166.184 g/mol

Monoisotopic Mass

166.097 g/mol

CAS Registry Number

66215-27-8

IUPAC Name

N2-cyclopropyl-1,3,5-triazine-2,4,6-triamine

Traditional Name

cyromazine

SMILES

NC1=NC(NC2CC2)=NC(N)=N1

InChI Identifier

InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)

InChI Key

LVQDKIWDGQRHTE-UHFFFAOYSA-N

Chemical Taxonomy

Description

belongs to the class of organic compounds known as n-aliphatic s-triazines. These are n-aliphatic amine derivatives of 1,3,5-triazines. 1,3,5-triazines are aromatic compounds having three nitrogen ring atoms at the 1-, 3-, and 5- positions.

Kingdom

Organic compounds

Super Class

Organoheterocyclic compounds

Class

Triazines

Sub Class

Aminotriazines

Direct Parent

N-aliphatic s-triazines

Alternative Parents

Substituents

N-aliphatic s-triazine
Secondary aliphatic/aromatic amine
1,3,5-triazine
Heteroaromatic compound
Azacycle
Secondary amine
Organic nitrogen compound
Organopnictogen compound
Hydrocarbon derivative
Primary amine
Organonitrogen compound
Amine
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic compounds

External Descriptors

triamino-1,3,5-triazine (CHEBI:30260 )
Pesticides (C14147 )
an aromatic compound (CPD-7403 )

Biological Properties

Status

Detected and Not Quantified

Origin

Exogenous

Cellular Locations

Cytoplasm
Extracellular

Biofluid Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Applications

triazine insecticide

Biological Roles

Not Available

Chemical Roles

Not Available

Physical Properties

State

Solid

Appearance

White powder.

Experimental Properties

Property	Value
Melting Point	219 - 222°C
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Property	Value	Source
Water Solubility	2.71 g/L	ALOGPS
logP	0.04	ALOGPS
logP	0.17	ChemAxon
logS	-1.8	ALOGPS
pKa (Strongest Acidic)	14.86	ChemAxon
pKa (Strongest Basic)	8.36	ChemAxon
Physiological Charge	1	ChemAxon
Hydrogen Acceptor Count	6	ChemAxon
Hydrogen Donor Count	3	ChemAxon
Polar Surface Area	102.74 Å²	ChemAxon
Rotatable Bond Count	2	ChemAxon
Refractivity	49.17 m³·mol⁻¹	ChemAxon
Polarizability	16.83 Å³	ChemAxon
Number of Rings	2	ChemAxon
Bioavailability	1	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Spectra

Spectrum Type	Description	Splash Key	View
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive	splash10-0173-3900000000-4a0ac062a0adfcc5b64c	Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positive	Not Available	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QTOF , positive	splash10-014i-0900000000-5dc8f82e24d5a0fd29ce	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QTOF , positive	splash10-014i-0900000000-050d94bd370514ff970b	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QTOF , positive	splash10-00or-0900000000-134377c670a9f0519686	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QTOF , positive	splash10-0ufr-0900000000-469f7c2021bae1b980cd	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QTOF , positive	splash10-0udi-0900000000-1ec89b2fddda26c37516	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - LC-ESI-QFT , positive	splash10-014i-2900000000-40be1b7e35476a62fba1	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 10V, Positive	splash10-014i-0900000000-d4081699f160e48ff189	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 20V, Positive	splash10-014i-0900000000-b1b89419891da555f0cc	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 30V, Positive	splash10-00or-0900000000-134377c670a9f0519686	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 50V, Positive	splash10-0udi-0900000000-d7c5686ed162b5ea5689	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 30V, Positive	splash10-00or-0900000000-00ed6e0592e66af5818c	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 50V, Positive	splash10-0udi-0900000000-1ec89b2fddda26c37516	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 10V, Positive	splash10-014i-0900000000-a718e01fadd25754181e	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 30V, Positive	splash10-00or-0900000000-200ce8f39a0e38f69f78	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 20V, Positive	splash10-014i-0900000000-cb4cad9abfb3804f36c1	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 30V, Positive	splash10-00or-0900000000-eefa0073e0318f6d243c	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 40V, Positive	splash10-0ufr-0900000000-469f7c2021bae1b980cd	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 20V, Positive	splash10-014i-0900000000-9c408324da9a91e24923	Spectrum
LC-MS/MS	LC-MS/MS Spectrum - 10V, Positive	splash10-014i-0900000000-788d57d49171f96b39f4	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Positive	splash10-014i-0900000000-5770727a05a959357472	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Positive	splash10-014i-3900000000-15c1a4ea36ce6899ae5b	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Positive	splash10-000f-9200000000-33f147cd6df29d158db1	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 10V, Negative	splash10-014i-1900000000-e606bf764cb109771a58	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 20V, Negative	splash10-0006-9300000000-96a44b35f39d73a7255e	Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 40V, Negative	splash10-001l-9300000000-7ae41094721900bb4f59	Spectrum
MS	Mass Spectrum (Electron Ionization)	splash10-0gb9-7900000000-402dbedad8e6bf2d7e1f	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum
1D NMR	1H NMR Spectrum	Not Available	Spectrum
1D NMR	13C NMR Spectrum	Not Available	Spectrum