Basic information
- CAS
27218-04-8- Standard SMILES
Cc1nc(N(C)C=O)nc(OC(=O)N(C)C)c1C- InChIKey
GDEAMEURJBBCOQ-UHFFFAOYSA-N- Molecular formula
- C11H16N4O3
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.12224039
Overview
See other relationships...
Names & identifiers
- Preferred name
- Desmethyl formamido piricarb
- IUPAC
- [2-[formyl(methyl)amino]-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamate
- English name
- Desmethyl-formamido-pirimicarb
- Molecular formula
- C11H16N4O3
- Molecular weight
- 252.27
Names & synonyms
Desmethyl formamido piricarb12A0I942DNRefChem:108318827218-04-8Desmethyl-formamido-pirimicarbPirimicarb IICarbamic acid, dimethyl-, 2-(formylmethylamino)-5,6-dimethyl-4-pyrimidinyl esterPirimicarb-desmethyl-formamido5,6-dimethyl-2-(N-methylformamido)pyrimidin-4-yl dimethylcarbamate[2-[formyl(methyl)amino]-5,6-dimethylpyrimidin-4-yl] N,N-dimethylcarbamateCarbamic acid, dimethyl-, ester with N-(4-hydroxy-5,6-dimethyl-2-pyrimidinyl)-N-methylformamidepirimicarb TP3
Show more names
Desmethylformamide pirimicarbCA16251300 Pirimicarb-desmethyl-formamidoPirimicarb-desmethyl-formamido in Acetonitrile2--5,6-dimethylpyrimidin-4-yl dimethylcarbamate2-[Formyl(methyl)amino]-5,6-dimethyl-4-pyrimidinyl dimethylcarbamatePyrimidin-4-ol, 2-formylmethylamino, 5,6-dimethyl, N,N-dimethylcarbamateDimethylcarbamic acid 2-(formylmethylamino)-5,6-dimethyl-4-pyrimidinyl estercarbamicacid,dimethyl-,2-(formylmethylamino)-5,6-dimethyl-4-pyrimidinylester
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 311
Experimental & physicochemical properties
SpringerMaterials PropertiesFusion temperature
PesticidesEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Physicochemical properties
- Boiling point
- 413.8 · 413.8±55.0 °C(Predicted)
- Density
- 1.229 · 1.229±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- 3.52 · 3.52±0.10(Predicted)
- Major Application
- agricultureenvironmental
- InChI
- 1S/C11H16N4O3/c1-7-8(2)12-10(15(5)6-16)13-9(7)18-11(17)14(3)4/h6H,1-5H3
- InChIKey
- GDEAMEURJBBCOQ-UHFFFAOYSA-N
- SMILES
- CN(C)C(=O)Oc1nc(nc(C)c1C)N(C)C=O
- FDA UNII
- 12 A0I942DN · 12A0I942DN
- UNSPSC Code
- 41116107 · 41116107
- NACRES
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN2811 6.1/PG 3
- risk_code
- 25-50/53
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS09
- hazard_code
- T,N
- safety_code
- 45-60-61
- Storage Class
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
- Hazard statements
- H301-H410
- Hazard Classifications
- Acute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1
- Precautionary statements
- P273-P301+P310+P330
Chemistry & industry
Uses & manufacturing
Use ClassificationEnvironmental transformation -> Pesticide transformation products (metabolite, successor)
Applications
UsesDesmethyl-formamido-pirimicarb may be used as an analytical reference standard for the determination of the analyte in food samples using modified quick, easy, cheap, effective, rugged, and safe (QuEChERS) extraction method followed by liquid chromatography-tandem mass spectrometry (LC-MS/MS).', 'Refer to the productμs Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
Suppliers14 total
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海艾梯西生物科技有限公司18721763493 · [email protected]
上海毕楷科技有限公司18516304666 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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