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Structure

1-Piperazinecarboxylicacid,4-(4-formylphenyl)-,1,1-dimethylethyl ester

CAS
197638-83-8
Catalog Number
ACM197638838
Category
Other Products
Molecular Weight
290.36
Molecular Formula
C16H22N2O3

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Specification

Synonyms
651427_ALDRICH, ZINC02563690, 1-Boc-4-(4-formylphenyl)piperazine, 4-(N-Boc-piperazin-1-yl)benzaldehyde, CID2795509, CC 30004, tert-Butyl 4-(4-formylphenyl)piperazine-1-carboxylate, 197638-83-8
IUPAC Name
tert-butyl 4-(4-formylphenyl)piperazine-1-carboxylate
Canonical SMILES
CC(C)(C)OC(=O)N1CCN(CC1)C2=CC=C(C=C2)C=O
InChI Key
KHORERZDMJTBMR-UHFFFAOYSA-N
Boiling Point
441.4ºC at 760mmHg
Melting Point
118-121ºC(lit.)
Flash Point
220.8ºC
Density
1.154g/cm³
Exact Mass
290.16300
Hazard Statements
T: Toxic;
H-Bond Acceptor
4
H-Bond Donor
0
Safety Description
S36/37

Upstream Synthesis Route 1

  • 459-57-4
  • 57260-71-6
  • 197638-83-8

Reference: [1] Patent: WO2016/57779, 2016, A2, . Location in patent: Page/Page column 68

Upstream Synthesis Route 2

  • 186650-98-6
  • 197638-83-8

Reference: [1] Chemical and Pharmaceutical Bulletin, 1997, vol. 45, # 9, p. 1458 - 1469
[2] Patent: US2005/239795, 2005, A1, . Location in patent: Page/Page column 13

Downstream Synthesis Route 1

  • 197638-83-8
  • 27913-99-1

Reference: [1] Patent: US2013/281397, 2013, A1,

Downstream Synthesis Route 2

  • 197638-83-8
  • 179328-27-9

Reference: [1]Chemical and Pharmaceutical Bulletin,1997,vol. 45,p. 1458 - 1469

Downstream Synthesis Route 3

  • 867-13-0
  • 197638-83-8
  • 1267666-48-7

Reference: [1]Patent: EP1396487,2004,A1 .Location in patent: Page 15

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

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