ChemicalBook--->CAS DataBase List--->18181-80-1

18181-80-1

18181-80-1 Structure

18181-80-1 Structure
IdentificationMore
[Name]

Bromopropylate
[CAS]

18181-80-1
[Synonyms]

4-Bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneacetic acid 1-methylethyl ester
ACAROL
ACAROL (TM)
BROMOPROPYLATE
BROMPROPYLAT
BROMPROPYLATE
ISOPROPYL-4,4'-DIBROMOBENZILATE
NEORON(R)
PHENISOBROMOLATE
1-methylethyl4-bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneacetate
1-methylethyl4-bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneacetate[qr]
4,4’-dibromobenzilicacidisopropylester
4,4’-dibromobenzilicacidisopropylester[qr]
4,4’-dibromo-benzilicaciisopropylester
4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-benzeneaceticaci1-methyleth
4-bromo-alpha-(4-bromophenyl)-alpha-hydroxy-benzeneaceticaci1-methylethyl
4-bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneaceticacid1-methylethyl
4-bromo-alpha-(4-bromophenyl)-alpha-hydroxybenzeneaceticacid1-methylethyles
ascarol2e
ascarol2e[qr]
[EINECS(EC#)]

242-070-7
[Molecular Formula]

C17H16Br2O3
[MDL Number]

MFCD00078632
[Molecular Weight]

428.12
[MOL File]

18181-80-1.mol
Chemical PropertiesBack Directory
[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)
Safety DataBack Directory
[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 ProductsBack Directory
[Raw materials]

Benzilic acid
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Phenisobromolate(18181-80-1).msds
Hazard InformationBack Directory
[Chemical Properties]

White crystals. Melting point 77°C, relative density 1.59, vapor pressure 1.066×10-5 Pa (20°C), 0.7 Pa (100°C). Soluble in various organic solvents, including acetone, benzene, isopropanol, methanol, and xylene; solubility in water at 20°C <0.5 mg/kg. Stable at room temperature and in neutral media, but unstable under acidic or alkaline conditions.
[Uses]

Acaricide.
Spectrum DetailBack Directory
[Spectrum Detail]

Bromopropylate(18181-80-1)MS
Bromopropylate(18181-80-1)1HNMR
Bromopropylate(18181-80-1)13CNMR
Bromopropylate(18181-80-1)IR1
Bromopropylate(18181-80-1)IR2
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

18181-80-1(sigmaaldrich)
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