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4-Arsenosobenzenamine

HCID 14290
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Basic information

CAS
1122-90-3
Standard SMILES
Nc1ccc([As]=O)cc1
InChIKey
VOLTUGUMYQENMY-UHFFFAOYSA-N
Molecular formula
C6H6AsNO
Average molar mass
183.04 g/mol
Monoisotopic mass
182.966533

Overview

RN given refers to parent cpd

Names & identifiers

Preferred name
4-Arsenosobenzenamine
IUPAC
4-arsorosoaniline
English name
p-Aminophenyl Arsenoxide
Molecular formula
C6H6AsNO
Molecular weight
183.04

Names & synonyms

1122-90-34-AminophenylarsenoxideBenzenamine, 4-arsenoso-4-ARSENOSOBENZENAMINEANILINE, p-ARSENOSO-Q80F4IJC71DTXSID70149955NSC-108764-arsenosoanilinepara-aminophenylarsenoxideRefChem:97865DTXCID9072446
Show more names
4-(oxoarsaneyl)aniline4-aminophenylarsine oxidep-Aminophenylarsenic oxide
p-Aminophenyl Arsenoxidep-Arsenosoaniline4-arsorosoanilineNSC10876(p-Aminophenyl)arsenoxideNSC 10876PAPAOC6H6AsNO

Database identifiers

CAS
1122-90-3
PubChem CID
14290
DTXSID
DTXSID70149955
ChEMBL
CHEMBL3290759
UNII
Q80F4IJC71
Nikkaji
J33.754D

Properties

Computed structural properties

Topological polar surface area
43.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Formal charge
0
Complexity
99.2

Physicochemical properties

Melting point
93 · 93-102°C
storage temp.
-20 °C · -20°C Freezer
solubility
Aqueous Acid (Slightly), Methanol (Slightly)
form
Solid
color
Off-White to Pale Brown
REACH Annex XVII Substances List
4 · 4-Aminophenylarsenoxide (1122-90-3)
FDA UNII
80 F4IJC71 · Q80F4IJC71
RIDADR
1557 · 1557
HazardClass
6.1 · 6.1(b)
PackingGroup
III
Toxicity
50 ipr-mus: · LD50 ipr-mus: 4 mg/kg JMCMAR 9,221,66

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

ridadr
1557
Toxicity
LD50 ipr-mus: 4 mg/kg JMCMAR 9,221,66
hazard_class
6.1(b)
packing_group
III

Chemistry & industry

Applications

Usesp-Aminophenyl Arsenoxide is a useful reagent for the study of 2-oxoacid dehydrogenase multienzyme complexes

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Compound notes

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