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10108-61-9

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Basic Information
CAS No.: 10108-61-9
Name: N-sec-butylphthalimide
Article Data: 10
Molecular Structure:
Molecular Structure of 10108-61-9 (N-sec-butylphthalimide)
Formula: C12H13 N O2
Molecular Weight: 203.241
Synonyms: Phthalimide,N-sec-butyl- (6CI,8CI);2-(1-Methylpropyl)-1H-isoindole-1,3(2H)-dione;N-sec-Butylphthalimide;NSC 5681;
EINECS: 233-295-1
Density: 1.187g/cm3
Melting Point: 33-35 °C
Boiling Point: 302.8°Cat760mmHg
Flash Point: 126°C
Safety: A poison by ingestion and skin contact.
PSA: 37.38000
LogP: 2.01900
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Chemistry

EINECS of N-sec-Butylphthalimide (CAS NO.10108-61-9): 233-295-1 
Empirical Formula: C12H13NO2
Molecular Weight: 203.2371 
Index of Refraction: 1.569
Density: 1.187 g/cm3
Flash Point: 126 °C
Enthalpy of Vaporization: 54.3 kJ/mol
Boiling Point: 302.8 °C at 760 mmHg
Vapour Pressure: 0.00097 mmHg at 25 °C
Structure of N-sec-Butylphthalimide (CAS NO.10108-61-9):
                        
IUPAC Name: 2-Butan-2-ylisoindole-1,3-dione
Canonical SMILES: CCC(C)N1C(=O)C2=CC=CC=C2C1=O
InChI: InChI=1S/C12H13NO2/c1-3-8(2)13-11(14)9-6-4-5-7-10(9)12(13)15/h4-8H,3H2,1-2H3
InChIKey: ZTXOTHWCDVUQRM-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-rat LD50:1100 µL/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 93 (1948),26.
2.    

orl-mus LD50:1600 µL/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 93 (1948),26.
3.    

orl-rbt LD50:2300 µL/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 93 (1948),26.
4.    

orl-gpg LD50:1200 µL/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 93 (1948),26.
5.    

skn-gpg LD50:>10 mL/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 93 (1948),26.

Consensus Reports

Reported in EPA TSCA Inventory.

Safety Profile

A poison by ingestion and skin contact.

Specification

 N-sec-Butylphthalimide (CAS NO.10108-61-9) also can be called N-sek.Butylftalimid ; 1H-Isoindole-1,3(2H)-dione, 2-(1-methylpropyl)- ; and Phthalimide, N-sec-butyl- .