10-Dimethylaminobornan-2-exo-ol supplier

Name
Bicyclo[2.2.1]heptan-2-ol, 1-[(dimethylamino)methyl]-7,7-dimethyl-, exo-
EINECS
CAS No. 58256-43-2
Density 1.003 g/cm³
Solubility
Melting Point
Formula C₁₂H₂₃NO
Boiling Point 255.6 °C at 760 mmHg
Molecular Weight 197.321
Flash Point 89.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 10-Dimethylaminobornan-2-exo-ol;
PSA 23.47000
LogP 1.73520

10-Dimethylaminobornan-2-exo-ol Specification

The 10-Dimethylaminobornan-2-exo-ol with the cas number 58256-43-2 is also called Bicyclo[2.2.1]heptan-2-ol,1-[(dimethylamino)methyl]-7,7-dimethyl-, exo- (9CI). The systematic name is (1S,2S,4S)-1-[(dimethylamino)methyl]-7,7-dimethylbicyclo[2.2.1]heptan-2-ol. Its molecular formula is C₁₂H₂₃NO. The product category is Chiral Reagents.

The properties of the chemical are: (1)ACD/LogP: 1.78; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1.65; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 23.47 Å²; (11)Index of Refraction: 1.509; (12)Molar Refractivity: 58.82 cm³; (13)Molar Volume: 196.7 cm³; (14)Polarizability: 23.32×10^-24cm³; (15)Surface Tension: 38.9 dyne/cm; (16)Enthalpy of Vaporization: 57.28 kJ/mol; (17)Vapour Pressure: 0.00244 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O[C@H]1C[C@@H]2CC[C@@]1(CN(C)C)C2(C)C
(2)InChI: InChI=1/C12H23NO/c1-11(2)9-5-6-12(11,8-13(3)4)10(14)7-9/h9-10,14H,5-8H2,1-4H3/t9-,10-,12-/m0/s1
(3)InChIKey: MIRJRWUZYBHBJV-NHCYSSNCBI

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	oral	400mg/kg (400mg/kg)	BEHAVIORAL: ANTICONVULSANT BEHAVIORAL: ANALGESIA	European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 412, 1975.

Product Name

Bicyclo[2.2.1]heptan-2-ol, 1-[(dimethylamino)methyl]-7,7-dimethyl-, exo-

10-Dimethylaminobornan-2-exo-ol Specification

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