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36519-25-2

Basic Information
CAS No.: 36519-25-2
Name: NEOSOLANIOL
Article Data: 4
Molecular Structure:
Molecular Structure of 36519-25-2 (NEOSOLANIOL)
Formula: C19H26 O8
Molecular Weight: 370.44
Synonyms: Spiro[2,5-methano-1-benzoxepin-10,2'-oxirane],trichothec-9-ene-3,4,8,15-tetrol deriv.; NSC 197212; Neosolaniol; Neozolaniol;Solaniol; Solaniol (sesquiterpene)
Density: 1.38g/cm3
Melting Point: 171.5°C
Boiling Point: 515.9°Cat760mmHg
Flash Point: 180.2°C
Hazard Symbols: T+,Xn,F
Risk Codes: 26/27/28-36-20/21/22-11
Safety: Poison by ingestion and intraperitoneal routes. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
PSA: 114.82000
LogP: 0.09570
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Chemistry

Empirical Formula of Neosolaniol (CAS NO.36519-25-2): C19H26O8
Molecular Weight: 382.4049 g/mol
Index of Refraction: 1.577
Density: 1.38 g/cm3
Flash Point: 180.2 °C
Enthalpy of Vaporization: 90.67 kJ/mol
Boiling Point: 515.9 °C at 760 mmHg
Vapour Pressure: 8.46E-13 mmHg at 25 °C 
Storage tempreture: 2-8 °C
Structure of Neosolaniol (CAS NO.36519-25-2):
                 

Toxicity Data With Reference

1.    

skn-gpg 370 ng MLD

    FAATDF    Fundamental and Applied Toxicology. 4 (2, Pt 2),(1984),S124.
2.    

ipr-mus LD50:14,500 µg/kg

    85GDA2    CRC Handbook of Antibiotic Compounds, Volumes 1-9. 6 (1981),190.
3.    

orl-ckn LD50:24,870 µg/kg

    AEMIDF    Applied and Environmental Microbiology. 35 (1978),636.

Safety Profile

Poison by ingestion and intraperitoneal routes. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
Hazard Codes of Neosolaniol (CAS NO.36519-25-2): VeryT+ ,HarmfulXn ,FlammableF
Risk Statements: 26/27/28-36-20/21/22-11 
R11:Highly flammable. 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R26/27/28:Very toxic by inhalation, in contact with skin and if swallowed. 
R36:Irritating to eyes.
Safety Statements: 22-36/37/39-45-36/37-16 
S16:Keep away from sources of ignition. 
S22:Do not breathe dust. 
S36/37:Wear suitable protective clothing and gloves. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

Specification

 Neosolaniol ,its cas register number is 36519-25-2. It also can be called Solaniol (VAN) ; Trichothec-9-ene-3,4,8,15-tetrol, 12,13-epoxy-, 4,15-diacetate ; and 4-beta,15-Diacetoxy-3-alpha,8-alpha-dihydroxy-12,13-epoxytrichothec-9-ene .