IUPAC: 2-Methylpent-1-en-3-one
Isopropenyl ethyl ketone with CAS NO. of 25044-01-3 is also called for CID32777 ; LS-102191 ; 25044-01-3 ; 2-Methyl-1-penten-3-one ; Ethyl isopropenyl ketone ; 1-Penten-3-one, 2-methyl- and so on.
CAS: 25044-01-3
Molecular Weight: 98.14
Molecular Formula: C6H10O
ACD/LogP: 1.12
ACD/LogD (pH 5.5): 1.12
ACD/LogD (pH 7.4): 1.12
ACD/BCF (pH 5.5): 4.2
ACD/BCF (pH 7.4): 4.2
ACD/KOC (pH 5.5): 97.27
ACD/KOC (pH 7.4): 97.27
H bond acceptors: 1
H bond donors: 0
Freely Rotating Bonds: 2
Heavy Atom Count: 7
Formal Charge: 0
Complexity: 92.4
Isotope Atom Count: 0
Defined Atom StereoCenter Count: 0
Undefined Atom StereoCenter Count: 0
Defined Bond StereoCenter Count: 0
Undefined Bond StereoCenter Count: 0
Covalently-Bonded Unit Count: 1
Index of Refraction: 1.407
Molar Refractivity: 29.44 cm3
Molar Volume: 119.5 cm3
Surface Tension: 22.7 dyne/cm
Density: 0.82 g/cm3
Flash Point: 28.2°C
Enthalpy of Vaporization: 35.67 kJ/mol
Boiling Point: 118.5°C at 760 mmHg
Vapour Pressure: 16.6 mmHg at 25°C
The molecular structure of Isopropenyl ethyl ketone with CAS NO. of 25044-01-3:
Isopropenyl ethyl ketone (CAS NO.25044-01-3) is used as chemical product and intermediate.
1. | skn-rbt 500 µL/24H SEV | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0539338-1 . | ||
2. | eye-rbt 100 µL/24H MLD | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0539338-1 . | ||
3. | orl-rat LD50:419 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0539338-1 . | ||
4. | skn-rbt LD50:841 mg/kg | NTIS** National Technical Information Service. (Springfield, VA 22161) (Formerly U.S. Clearinghouse for Scientific and Technical Information) OTS0539338-1 . |
Moderately toxic by ingestion and skin contact. A severe skin and mild eye irritant. When heated to decomposition it emits acrid smoke and irritating vapors.
Removal in wastewater treatment of Isopropenyl ethyl ketone (CAS NO.25044-01-3):
Total removal:7.71 percent
Total biodegradation:0.09 percent
Total sludge adsorption: 1.77 percent
Total to air:5.85 percent
(using 10000 hr Bio P,A,S)
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