CAS No.3853-88-1,CIS-5-NORBORNENE-ENDO-2,3-DICARBOXYLIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	3853-88-1
Name:	CIS-5-NORBORNENE-ENDO-2,3-DICARBOXYLIC ACID
Article Data:	6

Formula:	C₉H₁₀O₄
Molecular Weight:	182.176
Synonyms:	endo-Norbornene-cis-5,6-dicarboxylicacid;5-Norbornene-2,3-dicarboxylicacid, cis-endo- (8CI);Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid,(endo,endo)-;2-Norbornene-5,6-endo-cis-dicarboxylic acid;5-Norbornene-endo-2,3-dicarboxylic acid;Bicyclo[2.2.1]hept-5-ene-endo-cis-2,3-dicarboxylic acid;Carbic acid;Endicacid;Nadic acid;cis-3,6-Endomethylene-1,2,3,6-tetrahydrophthalic acid;cis-endo-Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid;endo-Bicyclo[2.2.1]heptene-5-ene-2,3-dicarboxylic acid;
EINECS:	223-301-0
Density:	1.481 g/cm³
Melting Point:	175 °C (dec.)(lit.)
Boiling Point:	419.796 °C at 760 mmHg
Flash Point:	221.833 °C
Appearance:	white to cream fine crystalline powder
Hazard Symbols:	Xn
Risk Codes:	20/21/22-36/37/38
Safety:	26-37/39
PSA:	74.60000
LogP:	0.59390

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Specification

The Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylicacid, (1R,2S,3R,4S)-rel-, with CAS registry number 3853-88-1, belongs to the following product categories: (1)Alicyclic/Etch-Resistant Monomers; (2)Lithography Monomers; (3)Self Assembly&Contact Printing. It has the systematic name of bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid. This chemical is a kind of white to cream fine crystalline powder. What's more, its EINECS is 223-301-0.

Physical properties of Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylicacid, (1R,2S,3R,4S)-rel-: (1)ACD/LogP: 0.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.37; (4)ACD/LogD (pH 7.4): -4.11; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 52.6 Å²; (13)Index of Refraction: 1.601; (14)Molar Refractivity: 42.15 cm³; (15)Molar Volume: 123 cm³; (16)Polarizability: 16.71×10^-24cm³; (17)Surface Tension: 69.5 dyne/cm; (18)Density: 1.481 g/cm³; (19)Flash Point: 221.8 °C; (20)Enthalpy of Vaporization: 73.88 kJ/mol; (21)Boiling Point: 419.8 °C at 760 mmHg; (22)Vapour Pressure: 3.18E-08 mmHg at 25°C.

Preparation: this chemical can be prepared by norborn-5-ene-2endo,3endo-dicarboxylic acid anhydride. This reaction will need reagent tetrahydrofuran.

Uses of Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylicacid, (1R,2S,3R,4S)-rel-: it can be used to produce (+-)-norborn-5-ene-2endo,3exo-dicarboxylic acid. This reaction will need reagent NaOEt.

When you are using this chemical, please be cautious about it as the following:
The Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylicacid, (1R,2S,3R,4S)-rel- irritates to eyes, respiratory system and skin. And this chemical is harmful by inhalation, in contact with skin and if swallowed. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C1C(C(=O)O)C2\C=C/C1C2
(2)InChI: InChI=1/C9H10O4/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13/h1-2,4-7H,3H2,(H,10,11)(H,12,13)
(3)InChIKey: NIDNOXCRFUCAKQ-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C9H10O4/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13/h1-2,4-7H,3H2,(H,10,11)(H,12,13)
(5)Std. InChIKey: NIDNOXCRFUCAKQ-UHFFFAOYSA-N