4-Bromo-2-iodo-6-nitroaniline

HCID 10688709CAS 180624-08-2
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1c(I)cc(Br)cc1[N+](=O)[O-]
InChIKey
CUVSESOKQSEEHQ-UHFFFAOYSA-N
Molecular formula
C6H4BrIN2O2
Average molar mass
342.92 g/mol
Monoisotopic mass
341.85008747

Names & identifiers

Preferred name
4-Bromo-2-iodo-6-nitroaniline
IUPAC
4-bromo-2-iodo-6-nitroaniline
English name
4-bromo-2-iodo-6-nitroaniline
Molecular formula
C6H4BrIN2O2
Molecular weight
342.92

Names & synonyms

4-bromo-2-iodo-6-nitroaniline180624-08-2MFCD11110560C6H4BrIN2O24-Bromo-2-iodo-6-nitrobenzenamineBenzenamine, 4-bromo-2-iodo-6-nitro-SCHEMBL222175DTXSID60443570(4-bromo-2-iodo-6-nitrophenyl)amineAKOS016000201AMY32310SB83279
Show more names
4-Bromo-2-iodo-7-nitroaniline4-BroMo-2-iodo-6-nitro-phenylaMine4-bromo-2-iodo-6-nitroaniline ISO 9001：2015 REACH
4-Bromo-2-iodo-6-nitroaniline, 97%DS-15717SY023691DB-367451CS-0097729F214598

Database identifiers

CAS
180624-08-2
PubChem CID
10688709
DTXSID
DTXSID60443570

Properties

Computed structural properties

XLogP
3
Topological polar surface area
71.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12

Physicochemical properties

Melting point
146 · 146-147 °C
Boiling point
356.7 · 356.7±42.0 °C(Predicted)
Density
2.418 · 2.418±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C(protect from light)
pka
-3.25 · -3.25±0.25(Predicted)
Appearance
Yellow to orange Solid

Safety & regulation

Safety data

hs_code
2921420090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Applications

Uses4-Bromo-2-iodo-6-nitroaniline is a useful research chemical compound.

Upstream & downstream products

Suppliers50 total

合肥胜航医药科技有限公司19156016681 18326946292 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
郑州汇聚化工有限公司13393710386 · [email protected]
上海志甾生物科技有限公司18156046398 · [email protected]

Related reactions

7 records
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Linked notes

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