-
Name
methyl (1aR,3aS,6aS)-1a,2-diformyl-5,5-dimethyl-1a,3a,4,5,6,6a-hexahydrocyclopropa[e]indene-6b(1H)-carboxylate
- EINECS
- CAS No. 2213-00-5
- Article Data4
- CAS DataBase
- Density 1.319g/cm3
- Solubility
- Melting Point
- Formula C16H20 O4
- Boiling Point 372.3°Cat760mmHg
- Molecular Weight 276.332
- Flash Point 162.6°C
- Transport Information
- Appearance
- Safety Mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Cycloprop[e]indene-6b(1H)-carboxylicacid, 1a,2-diformyl-1a,3a,4,5,6,6a-hexahydro-5,5-dimethyl-, methyl ester,(1aR,3aS,6aS,6bS)- (9CI); Cycloprop[e]indene-6b(1H)-carboxylic acid,1a,2-diformyl-1a,3a,4,5,6,6a-hexahydro-5,5-dimethyl-, methyl ester, [1aR-(1aa,3ab,6ab,6ba)]-; Marasmic acid, methyl ester(7CI); Methyl marasmate
- PSA 60.44000
- LogP 1.92610
Methyl marasmate Chemical Properties
Systematic Name: Methyl (1aR,3aS,6aS)-1a,2-diformyl-5,5-dimethyl-1a,3a,4,5,6,6a-hexahydrocyclopropa[e]indene-6b(1H)-carboxylate
Synonyms of Methyl marasmate (CAS NO.2213-00-5): Marasmic acid methyl ester ; Cycloprop(e)indene-6b(1H)-carboxylic acid, 1a,2-diformyl-1a,3a,4,5,6,6a-hexahydro-5,5-dimethyl-, methyl ester, (1aS-(1a-alpha,3a-beta,6a-beta,6b-alpha))-
CAS NO: 2213-00-5
Molecular Formula: C16H20O4
Molecular Weight : 276.3276
Molecular Structure: .png)
H bond acceptors: 4
H bond donors: 0
Freely Rotating Bonds: 4
Polar Surface Area: 60.44 Å2
Index of Refraction: 1.636
Molar Refractivity: 75.11 cm3
Molar Volume: 209.4 cm3
Surface Tension: 64.8 dyne/cm
Density: 1.319 g/cm3
Flash Point: 162.6 °C
Enthalpy of Vaporization: 61.94 kJ/mol
Boiling Point: 372.3 °C at 760 mmHg
Vapour Pressure: 9.72E-06 mmHg at 25°C
Methyl marasmate Toxicity Data With Reference
| 1. | mmo-sat 50 µg/disc | JANTAJ Journal of Antibiotics. 36 (1983),155. | ||
| 2. | dni-mus:ast 3 mg/L | JANTAJ Journal of Antibiotics. 36 (1983),155. |
Methyl marasmate Safety Profile
Mutation data reported. When Methyl marasmate (CAS NO.2213-00-5) is heated to decomposition, it emits acrid smoke and irritating fumes. See also ESTERS.
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