2008-41-5

Name Butylate
CAS 2008-41-5
EINECS(EC#) 217-916-3
Molecular Formula C4H7O2-
MDL Number MFCD00055338
Molecular Weight 87.1
MOL File 2008-41-5.mol

Chemical Properties

Appearance Butylate is a clear liquid with an aromatic odor.
Melting point  <25 °C
Boiling point  130°C (10 mmHg)
density  0.9402
refractive index  nD30 1.4701
storage temp.  0-6°C
form  Liquid
pka -1.22±0.70(Predicted)
color  Amber
Water Solubility  45mg/L(room temperature)
Merck  13,1545
BRN  1770420
Henry's Law Constant 1.2×10-1 mol/(m3Pa) at 25℃, HSDB (2015)
Major Application agriculture
environmental
InChI 1S/C11H23NOS/c1-6-14-11(13)12(7-9(2)3)8-10(4)5/h9-10H,6-8H2,1-5H3
InChIKey BMTAFVWTTFSTOG-UHFFFAOYSA-N
SMILES CCSC(=O)N(CC(C)C)CC(C)C
CAS DataBase Reference 2008-41-5(CAS DataBase Reference)
NIST Chemistry Reference Carbamothioic acid, bis(2-methylpropyl)-, s-ethyl ester(2008-41-5)
EPA Substance Registry System 2008-41-5(EPA Substance)

Safety Data

Hazard Codes  Xn;N,N,Xn
Risk Statements 
R20:Harmful by inhalation.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
Safety Statements 
S60:This material and/or its container must be disposed of as hazardous waste .
RIDADR  UN 3082
WGK Germany  2
RTECS  EZ7525000
TSCA  TSCA listed
HS Code  29033080
Storage Class 10 - Combustible liquids
Hazard Classifications Acute Tox. 4 Inhalation
Aquatic Chronic 2
Hazardous Substances Data 2008-41-5(Hazardous Substances Data)
Toxicity
LD50 oral in rat: 4gm/kg

Hazard Information

Material Safety Data Sheet(MSDS)

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