Structure

3-Chloro-4-iodoaniline

CAS
135050-44-1
Catalog Number
ACM135050441
Category
Amines
Molecular Weight
253.47
Molecular Formula
C6H5BrN2O2

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Specification

Hazard Statements
H302 + H312 + H332
RIDADR
UN 2811 6.1 / PGIII
Symbol
GHS07
What is the molecular formula of 3-Chloro-4-iodoaniline?

Molecular formula: C6H5ClIN

What is the molecular weight of 3-Chloro-4-iodoaniline?

Molecular weight: 253.47 g/mol

What are some synonyms for 3-Chloro-4-iodoaniline?

Synonyms: Benzenamine, 3-chloro-4-iodo-; 3-chloro-4-iodobenzenamine

When was 3-Chloro-4-iodoaniline created in PubChem?

Created: 2005-03-26

What is the InChIKey for 3-Chloro-4-iodoaniline?

InChIKey: ONZHMGRKWJMTDE-UHFFFAOYSA-N

What is the Canonical SMILES representation of 3-Chloro-4-iodoaniline?

Canonical SMILES: C1=CC(=C(C=C1N)Cl)I

What is the CAS number for 3-Chloro-4-iodoaniline?

CAS number: 135050-44-1

What is the XLogP3-AA value for 3-Chloro-4-iodoaniline?

XLogP3-AA value: 2.5

How many hydrogen bond donor counts does 3-Chloro-4-iodoaniline have?

Hydrogen bond donor count: 1

Is the compound 3-Chloro-4-iodoaniline canonicalized?

Yes, the compound is canonicalized.

Upstream Synthesis Route 1

  • 108-42-9
  • 6828-35-9
  • 135050-44-1

Reference: [1] Synlett, 2012, # 2, p. 208 - 214

Downstream Synthesis Route 1

  • 135050-44-1
  • 5345-54-0

Reference: [1] Synthesis, 1998, # 11, p. 1599 - 1603

Downstream Synthesis Route 2

  • 24010-80-8
  • 135050-44-1
  • 25058-98-4

Reference: [1]Journal of the Chemical Society,1951,p. 1774,1778

Downstream Synthesis Route 3

  • 135050-44-1
  • 4023-34-1
  • 23745-37-1

Reference: [1]Patent: DE1803084,1969,

Downstream Synthesis Route 4

  • 135050-44-1
  • 98-59-9
  • 889663-34-7

Reference: [1]Organic Letters,2006,vol. 8,p. 2043 - 2045

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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