CAS No.1931-62-0,PERKADOX PF-DBM25 Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1931-62-0
Name:	PERKADOX PF-DBM25

Formula:	C₈H₁₂O₅
Molecular Weight:	188.18
Synonyms:	2-Propeneperoxoicacid, 3-carboxy-, 1-(1,1-dimethylethyl) ester, (Z)-;Maleic monoperoxyacid,1-tert-butyl ester (8CI);Maleic monoperoxyacid, OO-tert-butyl ester (6CI,7CI);Luperco PMA 25;Perbutyl MA;Perbutyl MA 25;tert-Butyl monopermaleate;tert-Butyl monoperoxymaleate;tert-Butyl peroxymaleate;tert-Butyl peroxymaleicacid;
EINECS:	217-691-1
Density:	1.185 g/cm³
Melting Point:	130-131 °C
Boiling Point:	260.8 °C at 760 mmHg
Flash Point:	98 °C
Solubility:	642mg/L at 20℃
Appearance:	white viscous paste
Hazard Symbols:	Xn,O
Risk Codes:	7-41-36/38-22
Safety:	36/37/39-3/7-26-14A
PSA:	72.83000
LogP:	0.90050

Synthetic route

: 108-31-6
maleic anhydride

: 75-91-2
tert.-butylhydroperoxide

: 1931-62-0
OO-tert-butyl monoperoxymaleate

Conditions

Conditions	Yield
at 50 - 51℃;

: 20614-18-0
α-chloroethyl tert-butyl peroxide

: 1931-62-0
OO-tert-butyl monoperoxymaleate

: 86780-19-0
1-(tert-butylperoxy)ethyl tert-butyl peroxymaleate

Conditions

Conditions	Yield
With triethylamine In chloroform at 20℃; for 0.166667h;	91%

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Specification

The 2-Propeneperoxoic acid,3-carboxy-, 1-(1,1-dimethylethyl) ester, (2Z)-, with the CAS registry number 1931-62-0, is also known as CID5702664. Its EINECS registry number is 217-691-1. This chemical's molecular formula is C₈H₁₂O₅ and molecular weight is 188.17788. Its IUPAC name is called (Z)-4-tert-butylperoxy-4-oxobut-2-enoic acid. This chemical is white viscous paste.

Physical properties of 2-Propeneperoxoic acid,3-carboxy-, 1-(1,1-dimethylethyl) ester, (2Z)-: (1)ACD/LogP: 1.89; (2)#H bond acceptors: 5; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Index of Refraction: 1.469; (6)Molar Refractivity: 44.21 cm³; (7)Molar Volume: 158.7 cm³; (8)Surface Tension: 39.9 dyne/cm; (9)Density: 1.185 g/cm³; (10)Flash Point: 98 °C; (11)Enthalpy of Vaporization: 54.88 kJ/mol; (12)Boiling Point: 260.8 °C at 760 mmHg; (13)Vapour Pressure: 0.00358 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 will react exothermically with other chemicals. In addition, it is irritating to eyes and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. 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: CC(C)(C)OOC(=O)C=CC(=O)O
(2)Isomeric SMILES: CC(C)(C)OOC(=O)/C=C\C(=O)O
(3)InChI: InChI=1S/C8H12O5/c1-8(2,3)13-12-7(11)5-4-6(9)10/h4-5H,1-3H3,(H,9,10)/b5-4-
(4)InChIKey: RQHGZNBWBKINOY-PLNGDYQASA-N