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Name |
1-(2-Furyl)-2-nitroethylene |
EINECS | N/A |
CAS No. | 699-18-3 | Density | 1.270±0.06 g/cm3(Predicted) |
PSA | 58.96000 | LogP | 2.05020 |
Solubility | N/A | Melting Point |
72-75 °C(lit.) |
Formula | C6H5 N O3 | Boiling Point | 222.7±15.0 °C(Predicted) |
Molecular Weight | 139.111 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | A poison by ingestion. Moderately toxic by inhalation. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx. | Risk Codes | 20/21/22-41-37/38-22 |
Molecular Structure | Hazard Symbols | A poison by ingestion. Moderately toxic by inhalation. | |
Synonyms |
Furan,2-(2-nitrovinyl)- (6CI,7CI,8CI);(aE)-2-(2-Nitroethenyl)furan;1-(2-Furyl)-2-nitroethene;1-(a-Furyl)-2-nitroethylene;2-(2-Nitroethenyl)furan;2-(2-Nitrovinyl)furan;2-(Furan-2-yl)nitroethylene;2-Furylnitroethylene;G 0;NSC 5650; |
Article Data | 2 |
Molecular Structure of Furan, 2-(2-nitrovinyl)- (CAS NO.699-18-3):
IUPAC Name: 2-[(E)-2-Nitroethenyl]furan
Molecular Formula: C6H5NO3
Molecular Weight: 139.108800 g/mol
XLogP3: 1.6
H-Bond Donor: 0
H-Bond Acceptor: 3
Canonical SMILES: C1=COC(=C1)C=C[N+](=O)[O-]
Isomeric SMILES: C1=COC(=C1)/C=C/[N+](=O)[O-]
InChI: InChI=1S/C6H5NO3/c8-7(9)4-3-6-2-1-5-10-6/h1-5H/b4-3+
InChIKey: WVUICGOYGDHVBH-ONEGZZNKSA-N
Index of Refraction: 1.568
Molar Refractivity: 35.83 cm3
Molar Volume: 109.4 cm3
Surface Tension: 44.6 dyne/cm
Density: 1.27 g/cm3
Flash Point: 88.5 °C
Enthalpy of Vaporization: 44.05 kJ/mol
Boiling Point: 222.7 °C at 760 mmHg
Vapour Pressure: 0.149 mmHg at 25 °C
Melting Point: 72-75 °C(lit.)
Water Solubility: mg/L at 25 °C
BRN: 119552
1. | sce-hmn-lym 10 mg/L/48H | MUREAV Mutation Research. 497 (2001),177. | ||
2. | sce-hmn-lym 15 mg/L/3H | MUREAV Mutation Research. 497 (2001),177. | ||
3. | orl-rat LDLo:250 mg/kg | NCNSA6 National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. 5 (1953),33. | ||
4. | ihl-mus LCLo:305 mg/m3/10M | NDRC** National Defense Research Committee, Office of Scientific Research and Development, Progress Report NDCrc-132,NOV1942 . |
Safety Information of Furan, 2-(2-nitrovinyl)- (CAS NO.699-18-3):
Hazard Codes: Xi
Hazard Note: Irritant
Risk Statements: 20/21/22
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed
Safety Statements: 22-36/37
S22:Do not breathe dust
S36/37:Wear suitable protective clothing and gloves
WGK Germany: 3
RTECS: LU3325000
A poison by ingestion. Moderately toxic by inhalation. Mutation data reported. When heated to decomposition it emits toxic vapors of NOx.
Furan, 2-(2-nitrovinyl)- with CAS Registry Number of 699-18-3 is also known as 1-(2-Furyl)-2-nitroethylene ; 1-(alpha-Furyl)-2-nitroethylene ; 2-(2-Nitrovinyl)furan ; 2-Furylnitroethylene ; AI3-18224 ; CCRIS 5662 ; Ethylene, 1-(2-furyl)-2-nitro- ; NSC 5650 ; beta-Nitrovinylfuran ; 2-(2-Nitrovinyl)furan ; Furan, 2-(2-nitroethenyl)- (9CI) .