1-Adamantyl bromomethyl ketone supplier

Name
1-Adamantyl bromomethyl ketone
EINECS
CAS No. 5122-82-7
Article Data12
CAS DataBase
Density 1.439g/cm3
Solubility
Melting Point 76-79 °C(lit.)
Formula C12H17 Br O
Boiling Point 320.3ºC at 760 mmHg
Molecular Weight 257.17
Flash Point 61.1ºC
Transport Information
Appearance White crystalline powder
Safety
Risk Codes R36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Ketone,1-adamantyl bromomethyl (6CI,7CI,8CI); 1-(1-Adamantyl)-2-bromoethan-1-one;1-(1-Adamantyl)-2-bromoethanone; 1-(Adamantan-1-yl)-2-bromoethanone;1-(Bromoacetyl)adamantane; 1-Adamantyl bromomethyl ketone;1-Bromo-2-(1-adamantyl)ethan-2-one;2-Bromo-(1-tricyclo[3.3.1.13,7]dec-1-yl)ethanone; Adamantyl bromomethyl ketone
PSA 17.07000
LogP 3.16680

1-Adamantyl bromomethyl ketone Chemical Properties

Molecular Structure of 1-Adamantyl bromomethyl ketone (CAS No.5122-82-7):

Molecular Formula: C₁₂H₁₇BrO
Molecular Weight: 257.1668
CAS No: 5122-82-7
IUPAC Name: 1-(1-Adamantyl)-2-bromoethanone
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 2
Polar Surface Area: 17.07 Å²
Index of Refraction: 1.575
Molar Refractivity: 59.06 cm³
Molar Volume: 178.6 cm³
Surface Tension: 48 dyne/cm
Density: 1.439 g/cm³
Flash Point: 61.1 °C
Enthalpy of Vaporization: 56.2 kJ/mol
Boiling Point: 320.3 °C at 760 mmHg
Vapour Pressure: 0.00032 mmHg at 25°C
InChI: InChI=1/C₁₂H₁₇BrO/c13-7-11(14)12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10H,1-7H2
InChIKey: KWCDIRFSULAMOC-UHFFFAOYAD
Std. InChI: InChI=1S/C₁₂H₁₇BrO/c13-7-11(14)12-4-8-1-9(5-12)3-10(2-8)6-12/h8-10H,1-7H2
Std. InChIKey: KWCDIRFSULAMOC-UHFFFAOYSA-N
Classification Code: Drug / Therapeutic Agent
Product Categories: Adamantane derivatives;C11 to C12;Carbonyl Compounds;Ketones

1-Adamantyl bromomethyl ketone Toxicity Data With Reference

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	25mg/kg (25mg/kg)		Pharmaceutical Chemistry Journal Vol. 10, Pg. 454, 1976.

1-Adamantyl bromomethyl ketone Safety Profile

Hazard Codes: Irritant Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39-36/37/39-27
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39:Wear suitable gloves and eye/face protection.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S27:Take off immediately all contaminated clothing.
WGK Germany: 3

1-Adamantyl bromomethyl ketone Specification

1-Adamantyl bromomethyl ketone (CAS No.5122-82-7), its synonyms are 1-(Bromoacetyl)adamantane ; 2-Bromo-1-tricyclo(3.3.1.1(sup 3,7))dec-1-ylethanone ; Bromomethyl 1-adamantyl ketone ; Bromomethyl tricyclo[3.3.1.13,7]dec-1-yl ketone .

Product Name

1-Adamantyl bromomethyl ketone

1-Adamantyl bromomethyl ketone Chemical Properties

1-Adamantyl bromomethyl ketone Toxicity Data With Reference

1-Adamantyl bromomethyl ketone Safety Profile

1-Adamantyl bromomethyl ketone Specification

Related Products

Hot Products