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2,4-Diamino-6-phenyl-1,3,5-triazine

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2,4-Diamino-6-phenyl-1,3,5-triazine

EINECS 202-095-6
CAS No. 91-76-9 Density 1.347 g/cm3
PSA 90.71000 LogP 1.86540
Solubility 320mg/L at 25℃ Melting Point 219-221 °C(lit.)
Formula C9H9N5 Boiling Point 495.8 °C at 760 mmHg
Molecular Weight 187.204 Flash Point 285.8 °C
Transport Information N/A Appearance white crystalline powder
Safety 61 Risk Codes 22-52/53
Molecular Structure Molecular Structure of 91-76-9 (2,4-Diamino-6-phenyl-1,3,5-triazine) Hazard Symbols HarmfulXn
Synonyms

s-Triazine,2,4-diamino-6-phenyl- (6CI,8CI);2,4-Diamino-6-phenyl-s-triazine;2,6-Diamino-4-phenyl-1,3,5-triazine;2-Phenyl-4,6-diamino-1,3,5-triazine;2-Phenyl-4,6-diamino-s-triazine;4,6-Diamino-2-phenyl-s-triazine;6-Phenyl-1,3,5-triazine-2,4-diamine;Benzoguanamine;Benzoguanimine;ENT 60118;NSC 3267;

Article Data 41

2,4-Diamino-6-phenyl-1,3,5-triazine Chemical Properties

Product Name: Benzoguanamine (CAS NO.91-76-9)


Molecular Formula: C9H9N5
Molecular Weight: 187.2g/mol
Mol File: 91-76-9.mol
Einecs: 202-095-6
Appearance: White crystalline powder
Melting Point: 219-221 °C(lit.)
Boiling point: 495.8 °C at 760 mmHg
Flash Point: 285.8 °C
Density: 1.347 g/cm3
Surface Tension: 79.3 dyne/cm
Enthalpy of Vaporization: 76.34 kJ/mol
Vapour Pressure: 5.71E-10 mmHg at 25°C
XLogP3-AA: 1.4
H-Bond Donor: 2
H-Bond Acceptor: 5
Structure Descriptors of Benzoguanamine (CAS NO.91-76-9):
  IUPAC Name: 6-phenyl-1,3,5-triazine-2,4-diamine
  Canonical SMILES: C1=CC=C(C=C1)C2=NC(=NC(=N2)N)N
  InChI: InChI=1S/C9H9N5/c10-8-12-7(13-9(11)14-8)6-4-2-1-3-5-6/h1-5H,(H4,10,11,12,13,14) 
  InChIKey: GZVHEAJQGPRDLQ-UHFFFAOYSA-N
Product Categories: Intermediates of Dyes and Pigments; Heterocyclic Compounds; Benzenes

2,4-Diamino-6-phenyl-1,3,5-triazine Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   National Technical Information Service. Vol. AD277-689,

2,4-Diamino-6-phenyl-1,3,5-triazine Safety Profile

Safety Information of Benzoguanamine (CAS NO.91-76-9):
Hazard Codes: XnHarmful
Risk Statements: 22-52/53  
22:  Harmful if swallowed 
52:  Harmful to aquatic organisms 
53:  May cause long-term adverse effects in the aquatic environment 
Safety Statements: 61
61:  Avoid release to the environment. Refer to special instructions safety data sheet

2,4-Diamino-6-phenyl-1,3,5-triazine Specification

 Benzoguanamine ,its CAS NO. is 91-76-9,the synonyms is 1,3,5-Triazine, 2,4-diamino-6-phenyl- ; 1,3,5-Triazine-2,4-diamine, 6-phenyl- ; 2,4-Diamino-6-phenyl-s-triazine ; 2-Phenyl-4,6-diamino-1,3,5-triazine ; 2-Phenyl-4,6-diamino-s-triazine ; 4,6-Diamino-2-phenyl-s-triazine ; 4-26-00-01244 (Beilstein Handbook Reference) ; 6-Phenyl-1,3,5-triazine-2,4-diamine ; AI3-22162 ; BRN 0153223 ; CCRIS 9098 ; EINECS 202-095-6 ; ENT 60118 ; HSDB 5275 ; NSC 3267 ; USAF RH-5 ; s-Triazine, 2,4-diamino-6-phenyl- .

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