18181-80-1

Name Bromopropylate
CAS 18181-80-1
EINECS(EC#) 242-070-7
Molecular Formula C17H16Br2O3
MDL Number MFCD00078632
Molecular Weight 428.12
MOL File 18181-80-1.mol
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Chemical Properties

Melting point  77°
Boiling point  504°C (rough estimate)
density  1.5582 (rough estimate)
refractive index  1.6010 (estimate)
Fp  >100 °C
storage temp.  0-6°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  neat
pka 11.18±0.29(Predicted)
color  White to Off-White
Water Solubility  <0.5mg/L(20 ºC)
BRN  2152560
Major Application agriculture
environmental
InChI 1S/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3
InChIKey FOANIXZHAMJWOI-UHFFFAOYSA-N
SMILES CC(C)OC(=O)C(O)(c1ccc(Br)cc1)c2ccc(Br)cc2
CAS DataBase Reference 18181-80-1(CAS DataBase Reference)
NIST Chemistry Reference Bromopropylate(18181-80-1)
EPA Substance Registry System 18181-80-1(EPA Substance)
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Safety Data

Hazard Codes  Xi
Risk Statements 
R38:Irritating to the skin.
WGK Germany  2
RTECS  DD2100000
HS Code  29181990
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Acute 1
Aquatic Chronic 1
Hazardous Substances Data 18181-80-1(Hazardous Substances Data)
Toxicity
LD50 orally in rats: 5000 mg/kg (Kenaga, Allison)

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

Spectrum Detail

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