N-Isopropyl-N-methylsulfamide - CAS 372136-76-0
Catalog: |
BB063670 |
Product Name: |
N-Isopropyl-N-methylsulfamide |
CAS: |
372136-76-0 |
Synonyms: |
N-Methyl-N-(1-methylethyl)sulfamide; 2-[Methyl(sulfamoyl)amino]propane; N-Methyl-N-(1-methylethyl)-sulfamide |
IUPAC Name: | 2-[methyl(sulfamoyl)amino]propane |
Description: | N-Isopropyl-N-methylsulfamide is an intermediate in the synthesis of unlabeled Saflufenacil-d7 (S081802). Saflufenacil-d7 is the labeled version of Saflufenacil (S081800), which is a herbicide of the pyrimidinedione chemical class used for the preplant burndown and selective preemergence dicot weed control in different field crops. It was found to inhibit protoporphyrinogen IX oxidase (PPO) enzyme. |
Molecular Weight: | 152.22 |
Molecular Formula: | C4H12N2O2S |
Canonical SMILES: | CC(C)N(C)S(=O)(=O)N |
InChI: | InChI=1S/C4H12N2O2S/c1-4(2)6(3)9(5,7)8/h4H,1-3H3,(H2,5,7,8) |
InChI Key: | PJNPCKSPJXQBHH-UHFFFAOYSA-N |
Solubility: | Acetone; Dichloromethane; Methanol |
Appearance: | White Solid |
Storage: | -20°C Freezer, Under inert atmosphere |
References: | Knezevic, S., et al. Crop Prot., 29, 148 (2010); Grossmann, K., et al. Weed Sci., 58, 1 (2010). |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 168 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.0619488 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.0619488 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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