CAS No.10138-32-6,ETHYL 5-NORBORNENE-2-CARBOXYLATE (MIXTURE OF ENDO AND EXO) Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	10138-32-6
Name:	ETHYL 5-NORBORNENE-2-CARBOXYLATE (MIXTURE OF ENDO AND EXO)
Article Data:	6

Formula:	C₁₀H₁₄O₂
Molecular Weight:	166.22
Synonyms:	5-Norbornene-2-carboxylicacid, ethyl ester (6CI,7CI);5-Norbornenecarboxylic acid ethyl ester;Ethyl 5-norbornene-2-carboxylate;
Density:	1.089 g/cm³
Boiling Point:	216.164 °C at 760 mmHg
Flash Point:	75.303 °C
PSA:	26.30000
LogP:	1.76170

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Specification

The Bicyclo[2.2.1]hept-5-ene-2-carboxylicacid, ethyl ester, with the CAS registry number 10138-32-6, is also known as 5-Norbornenecarboxylic acid ethyl ester. It belongs to the product category of Norbornene Derivatives. This chemical's molecular formula is C₁₀H₁₄O₂ and molecular weight is 166.22. What's more, its systematic name is called Ethyl bicyclo[2.2.1]hept-5-ene-2-carboxylate.

Physical properties about Bicyclo[2.2.1]hept-5-ene-2-carboxylicacid, ethyl ester are: (1)ACD/LogP: 3.534; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.53; (4)ACD/LogD (pH 7.4): 3.53; (5)ACD/BCF (pH 5.5): 285.59; (6)ACD/BCF (pH 7.4): 285.59; (7)ACD/KOC (pH 5.5): 1992.61; (8)ACD/KOC (pH 7.4): 1992.61; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.508; (14)Molar Refractivity: 45.522 cm³; (15)Molar Volume: 152.625 cm³; (16)Polarizability: 18.046×10^-24cm³; (17)Surface Tension: 37.818 dyne/cm; (18)Density: 1.089 g/cm³; (19)Flash Point: 75.303 °C; (20)Enthalpy of Vaporization: 45.252 kJ/mol; (21)Boiling Point: 216.164 °C at 760 mmHg; (22)Vapour Pressure: 0.142 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC)C1CC2/C=C\C1C2
(2) InChI: InChI=1S/C10H14O2/c1-2-12-10(11)9-6-7-3-4-8(9)5-7/h3-4,7-9H,2,5-6H2,1H3
(3) InChIKey: FCCGTJAGEHZPBF-UHFFFAOYSA-N

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
rabbit	LD50	skin	> 5mL/kg (5mL/kg)		American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat	LD50	oral	4290uL/kg (4.29mL/kg)		American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.