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1878-88-2

Basic Information
CAS No.: 1878-88-2
Name: 3-Nitrophenoxyacetic acid
Article Data: 24
Molecular Structure:
Molecular Structure of 1878-88-2 (3-Nitrophenoxyacetic acid)
Formula: C8H7NO5
Molecular Weight: 197.147
Synonyms: Aceticacid, (3-nitrophenoxy)- (9CI);Acetic acid, (m-nitrophenoxy)- (6CI,7CI,8CI);NSC 193418;[(3-Nitrophenyl)oxy]acetic acid;m-Nitrophenoxyacetic acid;
EINECS: 217-528-4
Density: 1.445 g/cm3
Melting Point: 156-161 °C
Boiling Point: 389.65 °C at 760 mmHg
Flash Point: 189.454 °C
Appearance: yellow-beige crystalline powder
Hazard Symbols: HarmfulXn
Risk Codes: 44-36/37/38-22
Safety: 37/39-26
PSA: 92.35000
LogP: 1.58140
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Chemistry

 Product Name: (3-Nitrophenoxy)acetic acid (CAS NO.1878-88-2)


Molecular Formula: C8H7NO5
Molecular Weight: 197.14g/mol
Mol File: 1878-88-2.mol
EINECS: 217-528-4
Melting Point:  156-161 °C 
Boiling point: 389.7 °C at 760 mmHg
Flash Point: 189.5 °C
Density: 1.445 g/cm3
Surface Tension: 60.8 dyne/cm
Enthalpy of Vaporization: 67.4 kJ/mol
Vapour Pressure: 9.05E-07 mmHg at 25°C
XLogP3-AA: 1.4
H-Bond Donor: 1
H-Bond Acceptor: 5
Structure Descriptors of (3-Nitrophenoxy)acetic acid (CAS NO.1878-88-2):
  IUPAC Name: 2-(3-nitrophenoxy)acetic acid
  Canonical SMILES: C1=CC(=CC(=C1)OCC(=O)O)[N+](=O)[O-]
  InChI: InChI=1S/C8H7NO5/c10-8(11)5-14-7-3-1-2-6(4-7)9(12)13/h1-4H,5H2,(H,10,11) 
  InChIKey: BNRRQAASFDGMMQ-UHFFFAOYSA-N

Safety Profile

 Safety Information of (3-Nitrophenoxy)acetic acid (CAS NO.1878-88-2):
Hazard Codes: XnHarmful
Risk Statements: 44-36/37/38-22  
22:  Harmful if swallowed 
36:  Irritating to the eyes 
37:  Irritating to the respiratory system 
38:  Irritating to the skin
Safety Statements: 37/39-26
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 
37:  Wear suitable gloves 
39:  Wear eye/face protection

Specification

  (3-Nitrophenoxy)acetic acid , its CAS NO. is 1878-88-2, the synonyms are EINECS 217-528-4 ; NSC 193418 .