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4-Amyl-N-benzohydrylpyridinium bromide

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Name

4-Amyl-N-benzohydrylpyridinium bromide

EINECS N/A
CAS No. 63905-98-6 Density g/cm3
PSA 3.88000 LogP 2.34850
Solubility N/A Melting Point N/A
Formula C23H26 N . Br Boiling Point °Cat760mmHg
Molecular Weight 396.37 Flash Point °C
Transport Information N/A Appearance N/A
Safety Poison by ingestion, intraperitoneal, subcutaneous, and intravenous routes. See also BROMIDES. When heated to decomposition it emits very toxic fumes of NOx and Br. Risk Codes N/A
Molecular Structure Molecular Structure of 63905-98-6 (1-(diphenylmethyl)-4-pentylpyridinium bromide) Hazard Symbols N/A
Synonyms

1-Diphenylmethyl-4-pentylpyridiniumbromide (6CI); Pyridinium, 1-(diphenylmethyl)-4-pentyl-, bromide (9CI)

 

4-Amyl-N-benzohydrylpyridinium bromide Chemical Properties

Product Name: 4-Amyl-N-benzohydrylpyridinium bromide (CAS NO.63905-98-6)


Molecular Formula: C23H26BrN
Molecular Weight: 396.3632g/mol
Mol File: 63905-98-6.mol
H-Bond Donor: 0
H-Bond Acceptor: 1
Structure Descriptors of 4-Amyl-N-benzohydrylpyridinium bromide (CAS NO.63905-98-6):
  IUPAC Name: 1-Benzhydryl-4-pentylpyridin-1-ium bromide
  Canonical SMILES: CCCCCC1=CC=[N+](C=C1)C(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
  InChI: InChI=1S/C23H26N.BrH/c1-2-3-6-11-20-16-18-24(19-17-20)23(21-12-7-4-8-13-21)22-14-9-5-10-15-22;/h4-5,7-10,12-19,23H,2-3,6,11H2,1H3;1H/q+1;/p-1 
  InChIKey: QDADJNJFPRLXTP-UHFFFAOYSA-M

4-Amyl-N-benzohydrylpyridinium bromide Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 30mg/kg (30mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
guinea pig LD50 subcutaneous 15mg/kg (15mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
mouse LD50 intraperitoneal 4500ug/kg (4.5mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
mouse LD50 intravenous 1300ug/kg (1.3mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
mouse LD50 oral 35mg/kg (35mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
mouse LD50 subcutaneous 1600ug/kg (1.6mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
rabbit LD50 intravenous 10mg/kg (10mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
rabbit LD50 subcutaneous 35mg/kg (35mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
rat LD50 intraperitoneal 8mg/kg (8mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.
rat LD50 subcutaneous 4mg/kg (4mg/kg)   Federation Proceedings, Federation of American Societies for Experimental Biology. Vol. 9, Pg. 280, 1950.

4-Amyl-N-benzohydrylpyridinium bromide Safety Profile

Poison by ingestion, intraperitoneal, subcutaneous, and intravenous routes. See also BROMIDES. When heated to decomposition it emits very toxic fumes of NOx and Br.

4-Amyl-N-benzohydrylpyridinium bromide Specification

 4-Amyl-N-benzohydrylpyridinium bromide , its CAS NO. is 63905-98-6, the synonym is Pyridinium, N-(diphenylmethyl)-4-pentyl-, bromide .

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