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2-CHLORO-6-IODOANILINE

2-CHLORO-6-IODOANILINE structure

CAS No:
84483-28-3
Formula:
C6H5ClIN
Chemical Name:
2-CHLORO-6-IODOANILINE
Synonyms:
2-CHLORO-6-IODOANILINE;2-Amino-3-chloroiodobenzene;2-Chloro-6-iodoaniline 98+%
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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2-CHLORO-6-IODOANILINE Basic Attributes

Molecular Weight：

253.47

Exact Mass：

252.915512

DSSTox ID：

DTXSID70529213

HScode：

2921420090

Characteristics

PSA：

XLogP3：

2.5

Density：

2.0±0.1 g/cm3

Melting Point：

66-67°C

Boiling Point：

273.1°C at 760 mmHg

Flash Point：

119.0±23.2 °C

Refractive Index：

1.694

Safety Information

Hazard category：

IRRITANT

Marks：

2-CHLORO-6-IODOANILINE Use and Manufacturing

General procedure: A solution of 2-iodoaniline (333.6 mg, 1.52 mmol, 1.0 equiv) in DCM (5.0 mL) was added with Et3N (0.23 mL, 166.9 mg, 1.65 mmol, 1.1 equiv). The reaction solution was cooled at 0 C and acetyl chloride (0.28 mL, 308 mg, 3.92 mmol, 2.6 equiv) was added into the cooled solution. The resulting mixture was warmed to stir at room temperature overnight. Upon completion, thereaction was added with water and the separated aqueous phase was extracted with EtOAc (3xtimes). The combined organic phases were washed with sat. aq. NaCl, dried over anh. Na2SO4 and concentrated under reduced pressure. The crude material was purified by SiO2 column chromatography eluting with 30% EtOAc-hexane to yield 387.9 mg (98%) of the corresponding N-(2-iodophenyl)acetamide as a white solid.

Computed Properties

Molecular Weight:253.47
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Exact Mass:252.91552
Monoisotopic Mass:252.91552
Topological Polar Surface Area:26
Heavy Atom Count:9
Complexity:99.1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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2-CHLORO-6-IODOANILINE

CAS No.: 84483-28-3

Content: 99.00%

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