1-Chloropinacolone

1-Chloropinacolone Basic information

Product Name:	1-Chloropinacolone
Synonyms:	1-CHLORO-3,3-DIMETHYL-2-BUTANONE;1-CHLOROPINACOLIN;1-CHLOROPINACOLONE;MONOCHLOROPINAKOLONE;Chloropinacoline;1-CHLORO-3,3-DIMETHYL- 2-BUTANONE: CHLOROPINACOLONE;1-CHLORO-3,3-DIMETHYL-BUTANONE;3,3-dimethyl-1-Chlorobutan-2-one
CAS:	13547-70-1
MF:	C6H11ClO
MW:	134.6
EINECS:	236-920-6
Product Categories:	API Intermediate
Mol File:	13547-70-1.mol

1-Chloropinacolone Chemical Properties

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	2-Butanone, 1-chloro-3,3-dimethyl- (13547-70-1)

Safety Information

Hazard Codes	T,T+,Xi
Risk Statements	22-23-36/37/38-26-24
Safety Statements	26-36-45-38-36/37/39-28A-36/37-28
RIDADR	UN 2810
WGK Germany	3
RTECS	EL7078000
TSCA	Yes
HazardClass	6.1
PackingGroup	III
HS Code	29147000

MSDS Information

Provider	Language
1-Chloropinacolone	English
SigmaAldrich	English
ACROS	English
ALFA	English

1-Chloropinacolone Usage And Synthesis

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.
Hazard	A poison by ingestion. Low toxicity byinhalation.

1-Chloropinacolone Preparation Products And Raw materials

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

POE (2) OLEYL AMINE 2-CHLORO-2,2-DIFLUOROACETOPHENONE Dacthal 1,1-DICHLOROPINACOLIN DIMETHYLTHEXYLSILYL CHLORIDE KETAMINE/ZYLAZINE SOLUTION--SCHEDULE*III ITEM 16-alpha-chloro-3-methoxyoestra-1,3,5(10)-trien-17-one Chlortalidone KYNURENIC ACID Trazodone tert-Butyldimethylsilyl chloride 5ALPHA-ANDROSTAN-16ALPHA-CHLORO-17-ONE CHLORODIMETHYLVINYLSILANE METHYL 2-CHLORO-4,4-DIMETHYL-3-OXOPENTANOATE Acetone oxime 1-CHLORO-1-(4-CHLOROPHENYL)-3,3-DIMETHYLBUTAN-2-ONE Chlormezanone 4'-Chloroacetophenone

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