cis-1,2,3,6-Tetrahydrophthalimide supplier

Name
CIS-1,2,3,6-TETRAHYDROPHTHALIMIDE
EINECS 215-999-0
CAS No. 1469-48-3
Article Data17
CAS DataBase
Density 1.228 g/cm³
Solubility
Melting Point 129-133 °C(lit.)
Formula C₈H₉NO₂
Boiling Point 336.8 °C at 760 mmHg
Molecular Weight 151.165
Flash Point 165 °C
Transport Information
Appearance pale yellow or light beige to yellow-brownish
Safety 7-36/37/39-24/25
Risk Codes 20/21
Molecular Structure
Hazard Symbols Xn
Synonyms 1H-Isoindole-1,3(2H)-dione,3a,4,7,7a-tetrahydro-, cis-;4-Cyclohexene-1,2-dicarboximide, cis- (8CI);NSC41605;cis-4-Cyclohexene-1,2-dicarboximide;cis-Tetrahydrophthalimide;cis-D4-Tetrahydrophthalimide;
PSA 46.17000
LogP 0.55400

cis-1,2,3,6-Tetrahydrophthalimide Specification

The cis-1,2,3,6-Tetrahydrophthalimide, with the CAS registry number 1469-48-3, is also known as cis-4-Cyclohexene-1,2-dicarboximide. It belongs to the product category of Diels-Alder Adducts. Its EINECS registry number is 215-999-0. This chemical's molecular formula is C₈H₉NO₂ and molecular weight is 151.16256. Its IUPAC name is called (3aR,7aS)-3a,4,7,7a-tetrahydroisoindole-1,3-dione. It is stable at common pressure and temperature. The product should be sealed and stored in cool and dry place. What's more, it should be protected from strong oxides.

Physical properties of cis-1,2,3,6-Tetrahydrophthalimide: (1)ACD/LogP: 0.22; (2)ACD/LogD (pH 5.5): 0.22; (3)ACD/LogD (pH 7.4): 0.22; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 31.49; (7)ACD/KOC (pH 7.4): 31.49; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)Index of Refraction: 1.532; (11)Molar Refractivity: 38.15 cm³; (12)Molar Volume: 123 cm³; (13)Surface Tension: 42.1 dyne/cm; (14)Density: 1.228 g/cm³; (15)Flash Point: 165 °C; (16)Enthalpy of Vaporization: 57.99 kJ/mol; (17)Boiling Point: 336.8 °C at 760 mmHg; (18)Vapour Pressure: 0.00011 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful by inhalation and in contact with skin. You must avoid contact with skin and eyes. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1C=CCC2C1C(=O)NC2=O
(2)Isomeric SMILES: C1C=CC[C@H]2[C@@H]1C(=O)NC2=O
(3)InChI: InChI=1S/C8H9NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-2,5-6H,3-4H2,(H,9,10,11)/t5-,6+
(4)InChIKey: CIFFBTOJCKSRJY-OLQVQODUSA-N

Product Name

CIS-1,2,3,6-TETRAHYDROPHTHALIMIDE

cis-1,2,3,6-Tetrahydrophthalimide Specification

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