117658-14-7

Basic information

• Product Name: 1-BROMO-3,3-DIMETHYL-BUTAN-2-OL
• Synonyms: 1-BROMO-3,3-DIMETHYL-BUTAN-2-OL
• CAS NO: 117658-14-7
• Molecular Formula: C₆H₁₃BrO
• Molecular Weight: 181.07
• Mol File: 117658-14-7.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 192.436°C at 760 mmHg
• Flash Point: 70.427°C
• Appearance: /
• Density: 1.306g/cm³
• Vapor Pressure: 0.13mmHg at 25°C
• Refractive Index: 1.475
• CAS DataBase Reference: 1-BROMO-3,3-DIMETHYL-BUTAN-2-OL(CAS DataBase Reference)
• NIST Chemistry Reference: 1-BROMO-3,3-DIMETHYL-BUTAN-2-OL(117658-14-7)
• EPA Substance Registry System: 1-BROMO-3,3-DIMETHYL-BUTAN-2-OL(117658-14-7)

Safety Data

• Hazardous Substances Data: 117658-14-7(Hazardous Substances Data)

Usage

Physical State

Colorless liquid

Usage

a. Reagent in organic synthesis
b. Intermediate in the production of pharmaceuticals and other organic compounds
c. Preparation of various esters and ethers
d. Building block in the synthesis of complex organic molecules
e. Production of pesticides and other agricultural chemicals

Chemical Structure

a. Butanol group with a bromine atom attached to the first carbon atom
b. Two methyl groups attached to the third carbon atom

InChI:InChI=1/C6H13BrO/c1-6(2,3)5(8)4-7/h5,8H,4H2,1-3H3

Upstream product

• 2245-30-9 1,2-epoxy-3,3-dimethylbutane 
• 5469-26-1 1-Bromopinacolon 
• 558-37-2 tert-butylethylene 

Downstream Products

• 128864-73-3 (R)-Fluoro-phenyl-acetic acid (R)-1-bromomethyl-2,2-dimethyl-propyl ester 
• 128864-73-3 (S)-Fluoro-phenyl-acetic acid (R)-1-bromomethyl-2,2-dimethyl-propyl ester 
• 2245-30-9 1,2-epoxy-3,3-dimethylbutane 

Relevant articles and documents

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Male oral contraceptive N-alkylimidazole derivatives, compositions, and method of use therefor

A compound useful as antifungal, antibacterial and antiprotozoal agents and as spermicides have the formula STR1 and the acid addition salts thereof wherein Z is oxygen or sulfur; m is 0, 1, 2 or 3; n is 1, 2 or 3; R1 is hydrogen; alkyl; cycloalkyl; cycloalkyl-lower-alkyl; optionally substituted phenyl; phenyl-lower-alkyl; monocyclic heteroaromatic ring; monocyclic heteroaromatic-lower-alkyl; naphthyl; or naphthyl-lower-alkyl. A and B are independently hydrogen, halo, lower alkyl or lower alkoxy and either one of A or B may be nitro, amino or alkanoylamino; Q is (a) NR2 R3 or (b) NR4 C(X)YR5 wherein X is oxygen or sulfur; Y is oxygen, sulfur, NR6 or a bond; R2 is hydrogen; alkyl; cycloalkyl; cycloalkyl-lower-alkyl; optionally substituted phenyl or optionally substituted phenyl-lower-alkyl; R3 is hydrogen or lower alkyl; or R2 and R3 together with N is a five or six membered optionally substituted ring; R4 and R6 are independently hydrogen or lower alkyl; R5 is lower alkyl; cycloalkyl; phenyl; or optionally substituted phenyl or phenyl-lower-alkyl.