Name: CIS CIS-MUCONIC ACID
SKU: 1119-72-8

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Basic Information

Molecular Structure:
CAS No.:	1119-72-8
Name:	CIS CIS-MUCONIC ACID
Article Data:	14

Formula:	C₆H₆O₄
Molecular Weight:	142.111
Synonyms:	2,4-Hexadienedioicacid, (Z,Z)- (8CI);(Z,Z)-Muconic acid;cis,cis-Muconic acid;
EINECS:	208-017-7
Density:	1.365 g/cm³
Melting Point:	194-195 °C(lit.)
Boiling Point:	345.4 °C at 760 mmHg
Flash Point:	176.9 °C
Solubility:	freely soluble in boiling water, sparingly soluble in diethyl ether
Appearance:	yellow-beige crystalline powder
Hazard Symbols:	Xn
Risk Codes:	22-36/37/38
Safety:	26
PSA:	74.60000
LogP:	0.26800

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Specification

The 2,4-Hexadienedioicacid, (2Z,4Z)-, with the CAS registry number 1119-72-8, is also known as cis,cis-Muconic acid. This chemical's molecular formula is C₆H₆O₄ and molecular weight is 142.11. What's more, its systematic name is (2Z,4Z)-hexa-2,4-dienedioic acid. The product should be sealed and stored in containers with dry inert gas which are placed in cool and dry places. It should be protected from air.

Physical properties of 2,4-Hexadienedioicacid, (2Z,4Z)- are: (1)ACD/LogP: -0.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.43; (4)ACD/LogD (pH 7.4): -4.91; (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: 3; (12)Polar Surface Area: 52.6 Å²; (13)Index of Refraction: 1.548; (14)Molar Refractivity: 33.09 cm³; (15)Molar Volume: 104 cm³; (16)Polarizability: 13.11×10^-24cm³; (17)Surface Tension: 59.3 dyne/cm; (18)Density: 1.365 g/cm³; (19)Flash Point: 176.9 °C; (20)Enthalpy of Vaporization: 64.77 kJ/mol; (21)Boiling Point: 345.4 °C at 760 mmHg; (22)Vapour Pressure: 1.1E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful if swallowed. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should 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)\C=C/C=C\C(=O)O
(2)InChI: InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)/b3-1-,4-2-
(3)InChIKey: TXXHDPDFNKHHGW-CCAGOZQPSA-N