Product Name

  • Name

    3-Bromoadamantane-1-carboxylic acid

  • EINECS
  • CAS No. 21816-08-0
  • Article Data15
  • CAS DataBase
  • Density 1.665 g/cm3
  • Solubility
  • Melting Point 147 °C
  • Formula C11H15BrO2
  • Boiling Point 354.2 °C at 760 mmHg
  • Molecular Weight 259.143
  • Flash Point 168 °C
  • Transport Information
  • Appearance
  • Safety 26-36/37/39-37/39
  • Risk Codes 36/37/38
  • Molecular Structure Molecular Structure of 21816-08-0 (3-Bromoadamantane-1-carboxylic acid)
  • Hazard Symbols IrritantXi
  • Synonyms 1-Adamantanecarboxylicacid, 3-bromo- (7CI,8CI);1-Bromo-3-carboxyadamantane;1-Bromoadamantane-3-carboxylic acid;3-Bromo-1-adamantanecarboxylic acid;3-Bromo-1-carboxyadamantane;
  • PSA 37.30000
  • LogP 2.80490

3-Bromoadamantane-1-carboxylic acid Chemical Properties

Molecular structure of 3-Bromoadamantane-1-carboxylic acid (CAS NO.21816-08-0) is:

Product Name: 3-Bromoadamantane-1-carboxylic acid
CAS Registry Number: 21816-08-0
IUPAC Name: 3-bromoadamantane-1-carboxylic acid
Molecular Weight: 259.1396 [g/mol]
Molecular Formula: C11H15BrO2
XLogP3-AA: 2.4
H-Bond Donor: 1
H-Bond Acceptor: 2
Melting Point: 147 °C
Surface Tension: 67.3 dyne/cm
Density: 1.665 g/cm3
Flash Point: 168 °C
Enthalpy of Vaporization: 65.84 kJ/mol
Boiling Point: 354.2 °C at 760 mmHg
Vapour Pressure: 5.69E-06 mmHg at 25°C
Product Categories: Adamantane derivatives;C11 to C12;Carbonyl Compounds;Carboxylic Acids

3-Bromoadamantane-1-carboxylic acid Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 600mg/kg (600mg/kg)   Pharmaceutical Chemistry Journal Vol. 8, Pg. 396, 1974.
mouse LD50 unreported 600mg/kg (600mg/kg) BEHAVIORAL: ANTICONVULSANT Russian Pharmacology and Toxicology Vol. 43, Pg. 73, 1980.

3-Bromoadamantane-1-carboxylic acid Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S37/39:Wear suitable gloves and eye/face protection.
RTECS: AU4452500
Hazard Note: Irritant

3-Bromoadamantane-1-carboxylic acid Specification

 3-Bromoadamantane-1-carboxylic acid , its cas register number is 21816-08-0. It also can be called 1-Bromo-3-adamantanecarboxylic acid ; 3-Adamantanecarboxylic acid, 1-bromo- ; Tricyclo(3.3.1.1(sup 3,7))decane-1-carboxylic acid, 3-bromo-(9CI) .

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