Ametryn (HCID 13263)

Names & identifiers

Preferred name: Ametryn
IUPAC: 4-N-ethyl-6-methylsulfanyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
English name: Ametryn
Molecular formula: C9H17N5S
Molecular weight: 227.33

Names & synonyms

Ametryn834-12-8AMETRYNEGesapaxAmetrexEvikCemerinAmetrineCrisatrineAmephytDoruplantPrimatol Z 80

Show more names

BromoxynilAmetrina1093AMESIPG34162A 1093

Trinatox DGardopaxGeshpaxGesteneTopazol2-Ethylamino-4-isopropylamino-6-methylmercapto-s-triazine2-Ethylamino-4-isopropylamino-6-methylthio-1,3,5-triazineDTXSID1023869

Database identifiers

CAS: 834-12-8
PubChem CID: 13263
DTXSID: DTXSID1023869
ChEMBL: CHEMBL1235774
ChEBI: CHEBI:22472
UNII: 1SPQ95183Y
EC Number: 212-634-7
Nikkaji: J3.651J

Properties

Computed structural properties

XLogP: 3
Topological polar surface area: 88 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 15
Formal charge: 0
Complexity: 178

Physicochemical properties

Melting point: 84 · 84-85°C
Boiling point: 310.44 °C · 310.44°C (rough estimate)
Density: 1.1232 · 1.1232 (rough estimate)
vapor pressure: 0 Pa · 0Pa at 20℃
refractive index: 1.55 · 1.5500 (estimate)
Flash point: 11 °C · 11 °C
storage temp.: 2 · Keep in dark place,Sealed in dry,2-8°C
solubility: Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
form: Crystalline
pka: 3.71 · 3.71±0.41(Predicted)
color: White to off-white
Water Solubility: 209 mg/L · 209mg/L(25 ºC)
Merck: 13 · 13,391
BRN: 613099 · 613099
Henry's Law Constant: 2.1 · 2.1×101 mol/(m3Pa) at 25℃, Chao et al. (2017)
Major Application: agricultureenvironmental
InChI: 1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)
InChIKey: RQVYBGPQFYCBGX-UHFFFAOYSA-N
SMILES: CCNc1nc(NC(C)C)nc(SC)n1
LogP: 3 at · 3 at 20℃
CAS DataBase Reference: 834 · 834-12-8(CAS DataBase Reference)
EWG's Food Scores: 1 · 1
FDA UNII: 1 SPQ95183Y · 1SPQ95183Y
Proposition 65 List: Bromoxynil
NIST Chemistry Reference: 1 · 1,3,5-Triazine-2,4-diamine, N-ethyl-N'-(1-methylethyl)-6-(methylthio)-(834-12-8)
EPA Substance Registry System: Ametryn (834-12-8)
Pesticides Freedom of Information Act (FOIA): Bromoxynil
UNSPSC Code: 41116107 · 41116107
NACRES: 24 · NA.24
Symbol(GHS): 7 · GHS07,GHS09
Signal word: Warning
Hazard statements: 302 · H302-H410
Precautionary statements: 273 · P273-P301+P312+P330
PPE: 95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes: Xn;N,N,Xn,T,F
Risk Statements: 22 · 22-50/53-39/23/24/25-23/24/25-11
Safety Statements: 2 · 2-36-60-61-45-16-7
RIDADR: 1230 · UN 1230 3/PG 2
WGK Germany: 3 · 3
RTECS: 9100000 · XY9100000
HS Code: 29336990 · 29336990
Storage Class: 13 · 13 - Non Combustible Solids
Hazard Classifications: 4 OralAquatic · Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1
Hazardous Substances Data: 834 · 834-12-8(Hazardous Substances Data)
Toxicity: 50 in · LD50 in adult male, female rats (mg/kg): 508, 590 orally (Gaines, Linder)
REACH Registrations: Active

Safety & regulation

Safety data

PPE: dust mask type N95 (US), Eyeshields, Gloves
wgk: 3
rtecs: XY9100000
ridadr: UN 1230 3/PG 2
hs_code: 29336990
Toxicity: LD50 in adult male, female rats (mg/kg): 508, 590 orally (Gaines, Linder)
risk_code: 22-50/53-39/23/24/25-23/24/25-11
Signal word: Warning
Symbol(GHS): GHS07,GHS09
hazard_code: Xn;N,N,Xn,T,F
safety_code: 2-36-60-61-45-16-7
Storage Class: 13 - Non Combustible Solids
Hazard statements: H302-H410
REACH Registrations: Active
Hazard Classifications: Acute Tox. 4 OralAquatic Acute 1Aquatic Chronic 1
Precautionary statements: P273-P301+P312+P330
Hazardous Substances Data: 834-12-8(Hazardous Substances Data)

Chemistry & industry

Applications · 5 items

DescriptionAmetyn is a triazine herbicide. It is moderately soluble in water but much more so in organic solvents. It is quite volatile and not expected to leach to groundwater. It is moderately persistent in soils and can persist for a long time in water under certain conditions. It is moderately toxic to mammals and a recognised irritant. Ametryn is moderately toxic to most aquatic organisms, honeybees and earthworms but less so to birds.

UsesHerbicide used to control broad-leaved and grass weeds in corn, sugarcane, certain citrus subtropical fruits (bananas, pineapple) and in noncropland. Preharvest and postharvest desiccant used in potatoes to control both crop and weeds

UsesPre-emergence and post-emergence herbicides.

UsesAmetryn is a methylthiotriazine based herbicide which inhibits photosynthesis and other enzymatic processes. Ametryn is used to control broadleaf weeds and annual grasses in pineapple, sugarcane and b ananas.

General DescriptionCrystals. Melting point 190-192°F (88-89°C). Used as a herbicide.

Upstream & downstream products

Upstream raw materials

Suppliers50 total

上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

Shanghai Biolang Biotechnology Co., Ltd.+86-15970428662 +86-13397199602 · [email protected]

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

深圳市星凯越生物科技有限公司0755-18589069862 18589069862 · [email protected]

湖北科麦迪化工有限公司18372743325

Additional notes

DefinitionChEBI: A methylthio-1,3,5-triazine that is 2-(methylsulfanyl)-1,3,5-triazine substituted by an ethylamino and an isopropylamino group at positions 4 and 6 respectively.