Structure

2,6-Dimethylbenzoyl chloride

CAS
21900-37-8
Catalog Number
ACM21900378
Category
Other Products
Molecular Weight
168.62
Molecular Formula
C9H9ClO

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Specification

Synonyms
2,6-Dimethylbenzoyl chloride, Benzoyl chloride, 2,6-dimethyl-, MolPort-000-154-771, CID89096, EINECS 244-646-3, ZINC02510259, 21900-37-8
IUPAC Name
2,6-dimethylbenzoyl chloride
SMILES
CC1=C(C(=CC=C1)C)C(=O)Cl
InChI Key
CFLAYISSADVCJH-UHFFFAOYSA-N
Boiling Point
229.5ºC at 760mmHg
Flash Point
96.2ºC
Density
1.136g/cm³
EC Number
244-646-3
Exact Mass
168.03400
H-Bond Acceptor
1
H-Bond Donor
0

Upstream Synthesis Route 1

  • 632-46-2
  • 21900-37-8

Reference: [1]Bowman, W. Russell; Forshaw, J. Anthony; Hall, Kevin P.; Kitchin, Jonathan P.; Mott, Andrew W.
[Tetrahedron, 1996, vol. 52, # 11, p. 3961 - 3972]

Downstream Synthesis Route 1

  • 917-54-4
  • 21900-37-8
  • 2142-76-9

Reference: [1] Journal of Organic Chemistry, 1980, vol. 45, # 19, p. 3892 - 3902

Downstream Synthesis Route 2

  • 21900-37-8
  • 65399-02-2

Reference: [1] Farmaco, 1998, vol. 53, # 7, p. 513 - 518

Downstream Synthesis Route 3

  • 21900-37-8
  • 62285-58-9

Reference: [1] Helvetica Chimica Acta, 1960, vol. 43, p. 104 - 113

Downstream Synthesis Route 4

  • 21900-37-8
  • 55321-98-7

Reference: [1]Lock; Schmidt
[Journal fur praktische Chemie (Leipzig 1954), 1934, vol. <2> 140, p. 229,231]
[2]Adolphe-Pierre; Menager; Tombret; Verite; Lepage; Lafont
[Il Farmaco, 1998, vol. 53, # 7, p. 513 - 518]
[3]Hoque, Md Emdadul; Bisht, Ranjana; Unnikrishnan, Anju; Dey, Sayan; Mahamudul Hassan, Mirja Md; Guria, Saikat; Rai, Rama Nand; Sunoj, Raghavan B.; Chattopadhyay, Buddhadeb
[Angewandte Chemie - International Edition, 2022, vol. 61, # 27][Angew. Chem., 2022, vol. 134, # 27]

Downstream Synthesis Route 5

  • 67-56-1
  • 21900-37-8
  • 14920-81-1

Reference: [1]Chemische Berichte,1975,vol. 108,p. 1694 - 1711
[2]Patent: US7005440,2006,B1 .Location in patent: Page/Page column 150

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

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