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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 673649Generated: October 23, 2026

5-(2-Nitrophenyl)-2-furaldehyde

AKOS B022242 · AKOS BB-8348 · ASISCHEM N32003 · ART-CHEM-BB B022242 · TIMTEC-BB SBB000564 · 5-(2-NITROPHENYL)FURFURAL · 5-(2-Nitrophenyl)furfural,99% · 5-(2-NITROPHENYL)-2-FURALDEHYDE

https://huagongshe.com/en/chemical/673649

5-(2-Nitrophenyl)-2-furaldehyde molecular structure

Identifiers & Physical Properties

CAS No.20000-96-8
Molecular formulaC11H7NO4
Average molar mass217.18 g/mol
Monoisotopic mass217.0375077 g/mol
SMILESO=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1
InChIKeyQBYRUURYXPVDAK-UHFFFAOYSA-N
PubChem CID673649
EC No.624-559-0
DTXSIDDTXSID70350089

Chemical & Physical Properties

XLogP2.3
Topological polar surface area76
Hydrogen bond donors0
Hydrogen bond acceptors4
Rotatable bonds2
Heavy atoms16
Formal charge0
Complexity276
Melting point94-97 °C(lit.)
Boiling point105-107 °C30 mm Hg(lit.)
Density1.3654 (rough estimate)
Refractive index1.4900 (estimate)
Physical statesolid
InChI1S/C11H7NO4/c13-7-8-5-6-11(16-8)9-3-1-2-4-10(9)12(14)15/h1-7H
InChIKeyQBYRUURYXPVDAK-UHFFFAOYSA-N
SMILES[H]C(=O)c1ccc(o1)-c2ccccc2[N+]([O-])=O
CAS DataBase Reference20000-96-8(CAS DataBase Reference)
UNSPSC Code12352100
NACRESNA.22
GHS pictogramGHS07
Signal wordWarning
GHS hazard statementsH315-H319-H335
GHS precautionary statementsP261-P264-P271-P280-P302+P352-P305+P351+P338
Target organsRespiratory system
Personal protective equipment (PPE)dust mask type N95 (US), Eyeshields, Gloves
Hazard symbolsXi
Risk statements (R)36/37/38
Safety statements (S)26-36
Water hazard class (WGK)3
Customs code29321900
Storage class11 - Combustible Solids
Hazard classEye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & Regulations

GHS classificationWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 41 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Personal protective equipment (PPE)dust mask type N95 (US), Eyeshields, Gloves
Water hazard class (WGK)3
Customs code29321900
Risk statements (R)36/37/38
Signal wordWarning
GHS pictogramGHS07
Hazard symbolsXi
Safety statements (S)26-36
Storage class11 - Combustible Solids
Target organsRespiratory system
GHS hazard statementsH315-H319-H335
Hazard classEye Irrit. 2Skin Irrit. 2STOT SE 3
GHS precautionary statementsP261-P264-P271-P280-P302+P352-P305+P351+P338

Applications & Uses

Uses

5-(2-Nitrophenyl)furfural (5-(2-nitrophenyl)-2-furfuraldehyde) was used in the synthesis of (5-(2-nitrophenyl)furfuran-2-yl)methanol.It may be used in the synthesis of 2-{[5-(2-nitrophenyl)furan-2-yl]methyleneamino}benzoic acid (HOBZ) by reacting with 2-aminobenzoic acid.

General Description

5-(2-Nitrophenyl)furfural is a furfural derivative.