51218-49-6
Product Name:
Pretilachlor
Formula:
C17H26ClNO2
Synonyms:
2-Chloro-2′,6′-diethyl-N-(2-propoxyethyl)acetanilide
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Collision Cross Section | 149 Ų [M-H]- 158.6 Ų [M+H]+ 154.7 Ų [M+Na]+ 147.9 Ų [M-2H+Na]- |
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Kovats Retention Index | 2176.5 |
SAFETY INFORMATION
Signal word | Danger |
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Pictogram(s) |
Skull and Crossbones Acute Toxicity GHS06 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H331:Acute toxicity,inhalation |
Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
Molecular Weight | 311.8 g/mol |
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XLogP3 | 4.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 9 |
Exact Mass | 311.1652068 g/mol |
Monoisotopic Mass | 311.1652068 g/mol |
Topological Polar Surface Area | 29.5 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 287 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Pretilachlor is an anilide.