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ChemicalBook--->CAS DataBase List--->13547-70-1

13547-70-1

13547-70-1 Structure

13547-70-1 Structure
IdentificationMore
[Name]

1-Chloropinacolone
[CAS]

13547-70-1
[Synonyms]

1-CHLORO-3,3-DIMETHYL-2-BUTANONE
1-CHLORO-3,3-DIMETHYLBUTAN-2-ONE
1-CHLOROPINACOLIN
1-CHLOROPINACOLONE
CHLOROPINACOLONE
MONOCHLOROPINAKOLONE
TERT-BUTYL CHLOROMETHYL KETONE
TIMTEC-BB SBB006668
1-chloro-3,3-dimethyl-2-butanon
1-monochloropinacoline
alpha-chloropinacolin
alpha-chloropinacoline
alpha-Chloropinacolone
Chloromethyl tert-butyl ketone
chloromethyltert-butylketone
chlorpinakolin
Chloropinacoline
1-Chloropinacolone, 98+%
1-CHLORO-3,3-DIMETHYL-2-BUTANONE: CHLOROPINACOLONE
1-CHLORO-3,3-DIMETHYL-BUTANONE
[EINECS(EC#)]

236-920-6
[Molecular Formula]

C6H11ClO
[MDL Number]

MFCD00035688
[Molecular Weight]

134.6
[MOL File]

13547-70-1.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR SLIGHTLY YELLOW LIQUID
[Melting point ]

−13 °C(lit.)
[Boiling point ]

170-173 °C(lit.)
[density ]

1.025 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.442(lit.)
[Fp ]

153 °F
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

clear liquid
[color ]

Colorless to Yellow to Green
[Water Solubility ]

Not miscible in water.
[InChIKey]

ULSAJQMHTGKPIY-UHFFFAOYSA-N
[CAS DataBase Reference]

13547-70-1(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Butanone, 1-chloro-3,3-dimethyl-(13547-70-1)
[EPA Substance Registry System]

13547-70-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T,T+,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R23:Toxic by inhalation.
R36/37/38:Irritating to eyes, respiratory system and skin .
R26:Very Toxic by inhalation.
R24:Toxic in contact with skin.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S38:In case of insufficient ventilation, wear suitable respiratory equipment .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 2810
[WGK Germany ]

3
[RTECS ]

EL7078000
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29147000
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Methanol
[Preparation Products]

Triadimefon-->Diniconazole-->Pivaloylacetonitrile-->4-Amino-6-(tert-butyl)-3-mercapto-1,2,4-triazin-5(4H)-one-->Thiocyanic acid, 3,3-dimethyl-2-oxobutyl ester-->3,3-DIMETHYL-1-(2-NITROPHENOXY)-2-BUTANONE
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Chloropinacolone(13547-70-1).msds
Hazard InformationBack Directory
[Hazard]

A poison by ingestion. Low toxicity byinhalation.
[Chemical Properties]

CLEAR SLIGHTLY YELLOW LIQUID
[Uses]

1-Chloropinacolone is used as an intermediate for triazole compounds ( a five-membered ring structure compound contains three nitrogens and two carbons in the ring) which have biological activities such as antiviral, antibacterial, antifungal and antituberculous.
Spectrum DetailBack Directory
[Spectrum Detail]

1-Chloropinacolone(13547-70-1)MS
1-Chloropinacolone(13547-70-1)1HNMR
1-Chloropinacolone(13547-70-1)13CNMR
1-Chloropinacolone(13547-70-1)IR1
1-Chloropinacolone(13547-70-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1-Chloropinacolone, 95%(13547-70-1)
[Sigma Aldrich]

13547-70-1(sigmaaldrich)
[TCI AMERICA]

1-Chloropinacolin,>96.0%(GC)(13547-70-1)
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