-
Name
arsenocholine
- EINECS
- CAS No. 39895-81-3
- Density
- Solubility
- Melting Point
- Formula C5H14 As O
- Boiling Point
- Molecular Weight 165.087
- Flash Point
- Transport Information
- Appearance
- Safety Low toxicity by ingestion. Mutation data reported. When heated to decomposition it emits toxic vapors of As.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms (2-Hydroxyethyl)trimethylarsonium;Arsenocholine
- PSA 20.23000
- LogP 1.31690
Arsenocholine Chemical Properties
Molecular Structure of Arsenocholine (CAS NO. 39895-81-3):
IUPAC Name: 2-Hydroxyethyl(trimethyl)arsanium
Molecular Formula: C5H14AsO+
Molecular Weight: 165.085660 g/mol
H-Bond Donor: 1
H-Bond Acceptor: 1
Canonical SMILES: C[As+](C)(C)CCO
InChI: InChI=1S/C5H14AsO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1
InChIKey: ORLOBEXOFQEWFQ-UHFFFAOYSA-N
Freely Rotating Bonds: 3
Polar Surface Area: 9.23 Å2
Water Solubility of Arsenocholine (CAS NO. 39895-81-3): 5004 mg/L at 25 °C
Arsenocholine Toxicity Data With Reference
| 1. | cyt-hmn-fbr 30 mmol/L | MUREAV Mutation Research. 357 (1996),123. | ||
| 2. | orl-mus LD50:6500 mg/kg | JAFCAU Journal of Agricultural and Food Chemistry. 45 (1997),449. |
Arsenocholine Safety Profile
Low toxicity by ingestion. Mutation data reported. When heated to decomposition it emits toxic vapors of As.
Arsenocholine Specification
Arsenocholine with cas registry number of 39895-81-3 is also called for (2-Hydroxyethyl)trimethylarsonium ; Arsonium, (2-hydroxyethyl)trimethyl- .
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