-
Name
2-nitro-4-(oxoarsanyl)phenol
- EINECS
- CAS No. 102107-61-9
- Article Data4
- CAS DataBase
- Density
- Solubility
- Melting Point
- Formula C6H4 As N O4
- Boiling Point
- Molecular Weight 229.03
- Flash Point
- Transport Information
- Appearance
- Safety Poison by intravenous route. When heated to decomposition it emits toxic fumes of NOx and As.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Phenol,4-arsinoso-2-nitro- (2CI)
- PSA 83.12000
- LogP 0.61110
3-Nitro-4-hydroxyphenylarsenous acid Chemical Properties
IUPAC Name: 4-arsoroso-2-nitrophenol
Synonyms of 3-Nitro-4-hydroxyphenylarsenous acid (CAS NO.102107-61-9): 2-16-00-00448 (Beilstein Handbook Reference) ; 4-Arsenoso-2-nitrophenol ; BRN 3264522 ; Phenol, 4-arsenoso-2-nitro-
CAS NO: 102107-61-9
Molecular Formula of 3-Nitro-4-hydroxyphenylarsenous acid (CAS NO.102107-61-9): C6H4AsNO4
Molecular Weight: 229.0219
Molecular Structure:
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H bond acceptors: 5
H bond donors: 1
Freely Rotating Bonds: 3
Polar Surface Area of 3-Nitro-4-hydroxyphenylarsenous acid (CAS NO.102107-61-9): 72.12 Å2
Smiles: O=[N+]([O-])c1cc([As]=O)ccc1O
InChi: InChI=1/C6H4AsNO4/c9-6-2-1-4(7-10)3-5(6)8(11)12/h1-3,9H
InChIKey: JCHDSEMSNUAJSW-UHFFFAOYAM
Std. InChI: InChI=1S/C6H4AsNO4/c9-6-2-1-4(7-10)3-5(6)8(11)12/h1-3,9H
Std. InChIKey: JCHDSEMSNUAJSW-UHFFFAOYSA-N
3-Nitro-4-hydroxyphenylarsenous acid Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LDLo | intravenous | 7500ug/kg (7.5mg/kg) | Pharmaceutical Bulletin. Vol. 2, Pg. 19, 1954. | |
| rat | LD50 | intravenous | 5mg/kg (5mg/kg) | Journal of the American Chemical Society. Vol. 70, Pg. 1762, 1948. |
3-Nitro-4-hydroxyphenylarsenous acid Safety Profile
Poison by intravenous route. When heated to decomposition it emits toxic fumes of NOx and As.
3-Nitro-4-hydroxyphenylarsenous acid Standards and Recommendations
OSHA PEL: TWA 0.5 mg(As)/m3
ACGIH TLV: BEI: 35 µ (As)/L inorganic arsenic and methylated metabolites in urine
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