5-Nitrofurfuryl alcohol

HCID 17230CAS 2493-04-1
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Grundinformationen

Standard-SMILES
O=[N+]([O-])c1ccc(CO)o1
InChIKey
NDSTUUPEXNCUNW-UHFFFAOYSA-N
Summenformel
C5H5NO4
Durchschnittliche Molmasse
143,1 g/mol
Monoisotopische Masse
143,02185764

Namen und Bezeichner

Bevorzugter Name
5-Nitrofurfuryl alcohol
IUPAC
(5-nitrofuran-2-yl)methanol
Englischer Name
5-Nitrofurfuryl alcohol
Summenformel
C5H5NO4
Molmasse
143.1

Namen und Synonyme

5-Nitrofurfuryl alcohol2493-04-1FURFURYL ALCOHOL, 5-NITRO-AI3-23604NSC 6454BRN 0123848DTXSID60179640Furan, 2-hydroxymethyl-5-nitro-5-17-03-00350 (Beilstein Handbook Reference)RefChem:103266DTXCID20102131624-864-9
Weitere Namen anzeigen
5-Nitrofuryl alcohol(5-Nitrofuran-2-yl)5-nitro-2-furanmethano5-nitro-furfurylalcoho5-NITRO-2-FURFURYL ALCOHOL2-Furanmethanol, 5-nitro- (9CI)
NDSTUUPEXNCUNW-UHFFFAOYSA-N(5-nitrofuran-2-yl)methanol2-Furanmethanol, 5-nitro-5-Nitro-2-furanmethanol2-Furfuryl alcohol, 5-nitro-2-Hydroxymethyl-5-nitrofuranMFCD00272267NSC-6454

Datenbank-Bezeichner

CAS
2493-04-1
PubChem CID
17230
DTXSID
DTXSID60179640
UNII
SD64757V5Y
EC Number
624-864-9
Nikkaji
J37.041J

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,4
Polarare Oberfläche (TPSA)
79,2 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
1
Schwere Atome
10

Physikochemische Eigenschaften

Schmelzpunkt
30 · 30-32 °C
Siedepunkt
104 · 104-105 °C/3 mmHg (lit.)
Dichte
1.283 g/mL · 1.283 g/mL at 25 °C (lit.)
Brechungsindex
20 · n20/D 1.582(lit.)
Flammpunkt
230 °F · >230 °F
storage temp.
2 · 2-8°C

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Acute Tox. 4 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；Acute Tox. 4 (100%)；STOT SE 3 (100%)

Sicherheitsdaten

wgk
3
hs_code
2932190090
RTECS-Nr.
LU9174000
risk_code
20/21/22-36/37/38
hazard_code
Xn
safety_code
26-36

Chemie und Industrie

Anwendungen · 2 Einträge

BeschreibungNitrofurfuryl alcohol has been used as an antibacterial, antiprotozoal, and antihelminthic drug in human and animals. The mechanism of nitrofurfuryl alcohol toxicity is not clear but the nitro group is believed responsible for the carcinogenicity and mutagenicity of nitrofurfuryl alcohol.

Verwenden5-Nitrofurfuryl alcohol was used to investigate the reduction of some 2-substituted-5-nitrofuran compounds by rhodium complex [Rh(COD)(2-picoline)2](PF6) (COD = 1,5-cyclooctadiene) anchored on poly(4-vinylpyridine). It may be used for the synthesis of 5-nitrofurfuryl bromide and 5-nitrofurfurylamine hydrochloride.

Vor- und nachgelagerte Produkte

Anbieter39 Anbieter

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]

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