Basic information
- CAS
1121-47-7- Standard SMILES
ON=Cc1ccco1- InChIKey
UYTMLDBQFLIQJA-UHFFFAOYSA-N- Molecular formula
- C5H5NO2
- Average molar mass
- 111.1 g/mol
- Monoisotopic mass
- 111.0320284
Names & identifiers
- Preferred name
- N-(furan-2-ylmethylidene)hydroxylamine
- IUPAC
- N-(furan-2-ylmethylidene)hydroxylamine
- English name
- 2-Furaldehyde oxime
- Molecular formula
- C5H5NO2
- Molecular weight
- 111.1
Names & synonyms
furan-2-carbaldehyde oximeFurfuraldoximeN-(furan-2-ylmethylidene)hydroxylamineFurfuraldoximfuryl nitroneFurosemide Impurity 732-furancarbaldehyde oximeSCHEMBL1444944SCHEMBL10899181SCHEMBL11305740UYTMLDBQFLIQJA-UHFFFAOYSA-NBAA45058
Show more names
AKOS B004251FURFURALOXIME2-FURALDOXIMEFuran-2-aldoxime2-Furaldehyde oxime2-furancarboxaldehyde,oxime(E)-Furan-2-carbaldehyde oximeN-Hydroxy-2-furanylmethanimine
AKOS030239767N-[(furan-2-yl)methylidene]hydroxylamineDB-041045DB-293078G77396
Database identifiers
- CAS
1121-47-7- PubChem CID
- 14271
- DTXSID
DTXSID6061521
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 45.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 92
Physicochemical properties
- Melting point
- 78 °C · 78 °C
- Boiling point
- 208.19 °C · 208.19°C (rough estimate)
- Density
- 1.3113 · 1.3113 (rough estimate)
- refractive index
- 1.426 · 1.4260 (estimate)
- pka
- 11.36 · 11.36±0.10(Predicted)
- form
- crystalline solid
- color
- Off-white
- EPA Substance Registry System
- 2 · 2-Furancarboxaldehyde, oxime (1121-47-7)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302+H312+H332
- Precautionary statements
- 271 · P271-P280
- Hazard Codes
- Xi
- Hazard Note
- Irritant
- TSCA
- TSCA listed
- HS Code
- 2932190090 · 2932190090
Safety & regulation
Safety data
- tsca
- TSCA listed
- hs_code
- 2932190090
- Toxicity
- mouse,LD50,intraperitoneal,500mg/kg (500mg/kg),BEHAVIORAL: COMA,Journal of Pharmacology and Experimental Therapeutics. Vol. 119, Pg. 522, 1957.
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- Hazard statements
- H302+H312+H332
- Precautionary statements
- P271-P280
Chemistry & industry
Applications
Uses2-FURALDEHYDE OXIME is used as synthetic furan drugs.
Upstream & downstream products
Downstream products
Suppliers22 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
北京泰亚杰科技有限公司021-33690831-8001 13552411790;18616022633 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
Related reactions
6 records
Compound notes
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