Molecular Structure of (+)-3-Bromocamphor (CAS NO.10293-06-8):
IUPAC Name: (1R,3R,4S)-3-bromo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one
Empirical Formula: C10H15BrO
Molecular Weight: 231.1295
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 0
Polar Surface Area: 17.07 Å2
Index of Refraction: 1.528
Molar Refractivity: 52.18 cm3
Molar Volume: 169.2 cm3
Surface Tension: 37.2 dyne/cm
Density: 1.365 g/cm3
Flash Point: 35.8 °C
Enthalpy of Vaporization: 48.27 kJ/mol
Boiling Point: 245.6 °C at 760 mmHg
Vapour Pressure: 0.0284 mmHg at 25°C
Melting point: 75-78 °C(lit.)
EINECS: 233-652-1
Product Categories: Miscellaneous Biochemicals; Bicyclic Monoterpenes; Biochemistry; Terpenes
InChI
InChI=1/C10H15BrO/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6-7H,4-5H2,1-3H3
Smiles
C1([C@@]2(C([C@@H](Br)[C@@H]1CC2)=O)C)(C)C
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LD | oral | > 500mg/kg (500mg/kg) | National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 20, 1953. |
Hazard Codes: Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 3
RTECS: ED6750000
F: 8-10
(+)-3-Bromocamphor , with CAS number of 10293-06-8, can be called 2-Bornanone,3-bromo-, (1R,3S,4S)-(+)- (8CI) ; Bicyclo[2.2.1]heptan-2-one,3-bromo-1,7,7-trimethyl-, (1R-endo)- ; Camphor, 3a-bromo-, (+)- ; (+)-3-Bromocamphor ; (1R-endo)-3-Bromo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one . It is a white needles or crystalline powder.
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