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Product Name: Propylene formal (CAS NO.21962-24-3)
Molecular Formula: C6H12O2
Molecular Weight: 116.15828g/mol
Mol File: 21962-24-3.mol
Einecs: 244-683-5
Boiling point: 114.6 °C at 760 mmHg
Flash Point: 12.1 °C
Density: 0.864 g/cm3
Surface Tension: 23.2 dyne/cm
Enthalpy of Vaporization: 33.84 kJ/mol
Vapour Pressure: 23.4 mmHg at 25°C
XLogP3-AA: 0.9
H-Bond Donor: 0
H-Bond Acceptor: 2
Structure Descriptors of Propylene formal (CAS NO.21962-24-3):
IUPAC Name: (E)-1,1-dimethoxybut-2-ene
Canonical SMILES: CC=CC(OC)OC
Isomeric SMILES: C/C=C/C(OC)OC
InChI: InChI=1S/C6H12O2/c1-4-5-6(7-2)8-3/h4-6H,1-3H3/b5-4+
InChIKey: NOYRGONWBIVLEL-SNAWJCMRSA-N
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
rat | LC50 | inhalation | 400ppm/4H (400ppm) | BEHAVIORAL: GENERAL ANESTHETIC | AMA Archives of Industrial Health. Vol. 12, Pg. 623, 1955. |
Reported in EPA TSCA Inventory.
Moderately toxic inhalation. When heated to decomposition it emits acrid smoke and irritating fumes.
Propylene formal ,its CAS NO. is 21962-24-3,the synonyms is 2-Butenal dimethyl acetal ; 3-01-00-02979 (Beilstein Handbook Reference) ; BRN 1720659 ; Crotonaldehyde dimethyl acetal ; EINECS 244-683-5 ; 1,1-Dimethoxybut-2-ene ; 2-Butene, 1,1-dimethoxy- ; Crotonaldehyde, dimethyl acetal (6CI,7CI,8CI) .