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229-87-8

Basic Information
CAS No.: 229-87-8
Name: Phenanthridine
Article Data: 161
Molecular Structure:
Molecular Structure of 229-87-8 (Phenanthridine)
Formula: C13H9N
Molecular Weight: 179.221
Synonyms: 3,4-Benzoisoquinoline;3,4-Benzoquinoline;5-Azaphenanthrene;9-Azaphenanthrene;Benzo[c]quinoline;NSC 338473;NSC 73482;NSC 93336;
EINECS: 205-934-4
Density: 1.188 g/cm3
Melting Point: 104-107 °C(lit.)
Boiling Point: 350.436 °C at 760 mmHg
Flash Point: 155.851 °C
Solubility: 0.3g/L(20 oC)
Appearance: white to beige powder
Hazard Symbols: HarmfulXn
Risk Codes: 22-37/38-41
Safety: 26-39
Transport Information: UN 2811 6.1/PG 3
PSA: 12.89000
LogP: 3.38800
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Chemistry

Product Name: 6-Phenanthridine (CAS NO.229-87-8)


Molecular Formula: C13H9N
Molecular Weight: 179.22g/mol
Mol File: 229-87-8.mol
Appearance: White to beige powder
Melting Point: 104-107 °C(lit.)
Boiling point: 350.4 °C at 760 mmHg
Flash Point: 155.9 °C
Density: 1.187 g/cm3
Surface Tension: 54 dyne/cm
Enthalpy of Vaporization: 57.15 kJ/mol
Vapour Pressure: 8.89E-05 mmHg at 25°C
XLogP3-AA: 3.5
H-Bond Donor: 0
H-Bond Acceptor: 1
IUPAC Name: phenanthridine
Canonical SMILES: C1=CC=C2C(=C1)C=NC3=CC=CC=C23
InChI: InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9H 
InChIKey: RDOWQLZANAYVLL-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

mic-bac-sat 50 µg/plate

    50NNAZ    Polynuclear Aromatic Hydrocarbons: Mechanisms, Methods and Metabolism, Papers of the 8th International Symposium, Columbus, OH, 1983. 7 (1983),73.

Safety Profile

Safety Information of 6-Phenanthridine (CAS NO.229-87-8):
Hazard Codes: XnHarmful
Risk Statements: 22-37/38-41 
22:  Harmful if swallowed
37:  Irritating to the respiratory system 
38:  Irritating to the skin 
41:  Risk of serious damage to eyes
Safety Statements: 26-39
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
39:  Wear eye/face protection

Specification

 6-Phenanthridine ,its CAS NO. is 229-87-8,the synonyms is 3,4-Benzoisoquinoline ;  5-Azaphenanthrene ; Benzo(c)quinoline ; Phenanthridine .