Welcome to LookChem.com Sign In|Join Free
  • or
Home > Pharmaceutical > 51308 > 

51308-79-3

Products Categories

Basic Information
CAS No.: 51308-79-3
Name: S-((4-Bromophenyl)methyl) O-butyl-3-pyridinylcarbonimidothioate
Molecular Structure:
Molecular Structure of 51308-79-3 (S-((4-Bromophenyl)methyl) O-butyl-3-pyridinylcarbonimidothioate)
Formula: C17H19 Br N2 O S
Molecular Weight: 379.321
Synonyms: S-((4-Bromophenyl)methyl) O-butyl-3-pyridinylcarbonimidothioate
Density: 1.392g/cm3
Hazard Symbols: Moderately toxic by ingestion.
Safety: Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx, SOx, and Br−.
PSA: 70.78000
LogP: 5.66560
Related products
Hot Products
  • Display:default sort

    New supplier

  • Carbonimidothioic acid,3-pyridinyl-, S-[(4-bromophenyl)methyl] O-butyl ester (9CI)

  • Casno:

    51308-79-3

    Carbonimidothioic acid,3-pyridinyl-, S-[(4-bromophenyl)methyl] O-butyl ester (9CI)

    Min.Order: 1 Metric Ton

    FOB Price:  USD $ 1.0-1.0

    We are a Union of chemistry in China, consists of chemists，engineers, laboratories,factories in China. We organize surplus capacity of R&D and production as well as custom synthesis for chemical products and chemical business project. We are supp

    We are a Union of chemistry in China, consists of chemists，engineers, laboratories,factories in China. We organize surplus capacity of R&D and production in China for chemicals cus

  •  Bluecrystal chem-union

    China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:+86-1895157

    Address:Liang Xi Qu

       Inquiry Now

  • Total:2 Page 1 of 1 1
Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 51308-79-3

Chemistry

Molecule structure of S-((4-Bromophenyl)methyl) O-butyl 3-pyridinylcarbonimidothioate (CAS NO.51308-79-3):

IUPAC Name: S-[(4-Bromophenyl)methyl] N-(2-butylpyridin-3-yl)carbamothioate 
Molecular Weight: 379.31456 g/mol
Molecular Formula: C17H19BrN2OS 
Density: 1.392 g/cm3
Index of Refraction: 1.635
Molar Refractivity: 97.6 cm3
Molar Volume: 272.4 cm3
Polarizability: 38.69×10-24 cm3
Surface Tension: 52.8 dyne/cm
XLogP3-AA: 4.9
H-Bond Donor: 1
H-Bond Acceptor: 2
Rotatable Bond Count: 7
Tautomer Count: 4
Exact Mass: 378.040147
MonoIsotopic Mass: 378.040147
Topological Polar Surface Area: 42
Heavy Atom Count: 22
Complexity: 335
Canonical SMILES: CCCCC1=C(C=CC=N1)NC(=O)SCC2=CC=C(C=C2)Br
InChI: InChI=1S/C17H19BrN2OS/c1-2-3-5-15-16(6-4-11-19-15)20-17(21)22-12-13-7-9-14(18)10-8-13/h4,6-11H,2-3,5,12H2,1H3,(H,20,21)
InChIKey of S-((4-Bromophenyl)methyl) O-butyl 3-pyridinylcarbonimidothioate (CAS NO.51308-79-3): UMEADEMSHXYHTC-UHFFFAOYSA-N

Toxicity Data With Reference

1.    

orl-mus LD50:>1 g/kg

     USXXAM    United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #3899582 .

Safety Profile

Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx, SOx, and Br−.

Specification

 S-((4-Bromophenyl)methyl) O-butyl 3-pyridinylcarbonimidothioate (CAS NO.51308-79-3) is also named as Carbonimidothioic acid, 3-pyridinyl-, S-((4-bromophenyl)methyl) O-butyl ester .