Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide supplier

Name
2-hydroxyethyl-dimethyl-[2-oxo-2-(4-phenylphenyl)ethyl]azanium bromide
EINECS
CAS No. 77985-00-3
Density
Solubility
Melting Point
Formula C18H22 N O2 . Br
Boiling Point
Molecular Weight 364.32
Flash Point
Transport Information
Appearance
Safety A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NO_x and Br⁻.
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms [1,1'-Biphenyl]-4-ethanaminium,N-(2-hydroxyethyl)-N,N-dimethyl-b-oxo-, bromide (9CI)
PSA 37.30000
LogP -0.39100

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Chemical Properties

Molecular Structure of Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide (CAS NO. 77985-00-3):

IUPAC Name: 2-Hydroxyethyl-dimethyl-[2-oxo-2-(4-phenylphenyl)ethyl]azanium bromide
Molecular Formula: C₁₈H₂₂BrNO₂
Molecular Weight: 364.276780 g/mol
H-Bond Donor: 1
H-Bond Acceptor: 3
Freely Rotating Bonds: 7
Canonical SMILES: C[N+](C)(CCO)CC(=O)C1=CC=C(C=C1)C2=CC=CC=C2.[Br-]
InChI: InChI=1S/C18H22NO2.BrH/c1-19(2,12-13-20)14-18(21)17-10-8-16(9-11-17)15-6-4-3-5-7-15;/h3-11,20H,12-14H2,1-2H3;1H/q+1;/p-1
InChIKey: QSWIBFIOVMXNHP-UHFFFAOYSA-M
Polar Surface Area of Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide (CAS NO. 77985-00-3): 26.3Å²

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Toxicity Data With Reference

ipr-mus LD50:2500 µg/kg

JPETAB Journal of Pharmacology and Experimental Therapeutics. 115 (1955),127.

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Safety Profile

A poison by intraperitoneal route. When heated to decomposition it emits toxic vapors of NO_x and Br⁻.

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Specification

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide with cas registry number of 77985-00-3 is also named as (4-Biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)ammonium bromide .

Product Name

2-hydroxyethyl-dimethyl-[2-oxo-2-(4-phenylphenyl)ethyl]azanium bromide

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Chemical Properties

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Toxicity Data With Reference

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Safety Profile

Ammonium, (4-biphenylcarbonylmethyl)dimethyl(2-hydroxyethyl)-, bromide Specification

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