CAS No.699-18-3,1-(2-FURYL)-2-NITROETHYLENE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	699-18-3
Name:	1-(2-FURYL)-2-NITROETHYLENE
Article Data:	2

Formula:	C6H5 N O3
Molecular Weight:	139.111
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;
Density:	1.270±0.06 g/cm3(Predicted)
Melting Point:	72-75 °C(lit.)
Boiling Point:	222.7±15.0 °C(Predicted)
Hazard Symbols:	A poison by ingestion. Moderately toxic by inhalation.
Risk Codes:	20/21/22-41-37/38-22
Safety:	A poison by ingestion. Moderately toxic by inhalation. Mutation data reported. When heated to decomposition it emits toxic vapors of NO_x.
PSA:	58.96000
LogP:	2.05020

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Chemistry

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

Toxicity Data With Reference

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 Profile

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 NO_x.

Specification

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) .