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Basic Information
CAS No.: 53055-05-3
Name: 3-Methoxy-2-nitrobenzaldehyde
Molecular Structure:
Molecular Structure of 53055-05-3 (3-Methoxy-2-nitrobenzaldehyde)
Formula: C8H7 N O4
Molecular Weight: 181.148
Synonyms: m-Anisaldehyde,2-nitro- (6CI); 2-Nitro-3-methoxybenzaldehyde; 3-Methoxy-2-nitrobenzaldehyde;NSC 172558
EINECS: 258-332-9
Density: 1.322g/cm3
Melting Point: 97-101 ºC
Boiling Point: 344.2°Cat760mmHg
Flash Point: 177.3°C
Appearance: White to beige or yellow crystalline powder
Safety: 22-24/25
PSA: 72.12000
LogP: 1.93910
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Chemistry

Product Name: Benzaldehyde,3-methoxy-2-nitro- (CAS NO.53055-05-3)

Molecular Formula: C8H7NO4
Molecular Weight: 181.14g/mol
Mol File: 53055-05-3.mol
EINECS: 258-332-9
Appearance: White to beige or yellow crystalline powder
Melting Point: 97-101 °C(lit.)
Index of Refraction: 1.59 
Molar Refractivity: 46.22 cm3 
Molar Volume: 136.9 cm3   
Surface Tension: 50.1 dyne/cm 
Density: 1.322 g/cm3 
Flash Point: 177.3 °C 
Enthalpy of Vaporization: 58.81 kJ/mol 
Boiling Point: 344.2 °C at 760 mmHg 
Vapour Pressure: 6.7E-05 mmHg at 25°C
XLogP3-AA: 1
H-Bond Donor: 0
H-Bond Acceptor: 4
Structure Descriptors of Benzaldehyde,3-methoxy-2-nitro- (CAS NO.53055-05-3):
  IUPAC Name: 3-methoxy-2-nitrobenzaldehyde
  Canonical SMILES: COC1=CC=CC(=C1[N+](=O)[O-])C=O
  InChI: InChI=1S/C8H7NO4/c1-13-7-4-2-3-6(5-10)8(7)9(11)12/h2-5H,1H3 
  InChIKey: GDTUACILWWLIJF-UHFFFAOYSA-N
Product Categories: Aromatic Aldehydes & Derivatives (substituted); Aldehydes; C8; Carbonyl Compounds

Safety Profile

Safety Information of Benzaldehyde,3-methoxy-2-nitro- (CAS NO.53055-05-3):
Safety Statements: 22-24/25 
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3

Specification

 Benzaldehyde,3-methoxy-2-nitro- , its CAS NO. is 53055-05-3, the synonyms are 2-Nitro-3-methoxy benzaldehyde ; 3-Methoxy-2-nitrobenzaldehyde .