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Structure

Decanedioic acid,1,10-bis(2,5-dioxo-1-pyrrolidinyl)ester

CAS
23024-29-5
Catalog Number
ACM23024295
Category
Other Products
Molecular Weight
396.4g/mol
Molecular Formula
C18H24N2O8

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Specification

IUPAC Name
bis(2,5-dioxopyrrolidin-1-yl) decanedioate
Canonical SMILES
C1CC(=O)N(C1=O)OC(=O)CCCCCCCCC(=O)ON2C(=O)CCC2=O
InChI
InChI=1S/C18H24N2O8/c21-13-9-10-14(22)19(13)27-17(25)7-5-3-1-2-4-6-8-18(26)28-20-15(23)11-12-16(20)24/h1-12H2
InChI Key
XPKIVYVYXKPGBP-UHFFFAOYSA-N
Complexity
572
Covalently-Bonded Unit Count
1
Exact Mass
396.153266g/mol
Formal Charge
0
H-Bond Acceptor
8
H-Bond Donor
0
Heavy Atom Count
28
Monoisotopic Mass
396.153266g/mol
Rotatable Bond Count
13
XLogP3
1

Upstream Synthesis Route 1

  • 6066-82-6
  • 111-20-6
  • 23024-29-5

Reference: [1]Kondo, Michio; Shimizu, Yoshikazu; Murata, Akira
[Agricultural and Biological Chemistry, 1982, vol. 46, # 4, p. 913 - 918]
[2]Zhuang, Chen; Tao, Fu-Rong; Cui, Yue-Zhi
[Chemical Papers, 2016, vol. 70, # 4, p. 505 - 514]

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