(Q27282918)

2-[(1Z)-1-Octen-1-yl]succinic acid (English)

14 October 2016

chemical formula

C₁₂H₂₀O₄

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CCCCCCC=CC(CC(=O)O)C(=O)O

1 reference

(1Z)-1-octenylsuccinic acid (English)

14 October 2016

isomeric SMILES

CCCCCC/C=C\C(CC(=O)O)C(=O)O

1 reference

(1Z)-1-octenylsuccinic acid (English)

InChI=1S/C12H20O4/c1-2-3-4-5-6-7-8-10(12(15)16)9-11(13)14/h7-8,10H,2-6,9H2,1H3,(H,13,14)(H,15,16)/b8-7-

14 October 2016

Identifiers

InChI

1 reference

(1Z)-1-octenylsuccinic acid (English)

KCYQMQGPYWZZNJ-FPLPWBNLSA-N

14 October 2016

InChIKey

1 reference

(1Z)-1-octenylsuccinic acid (English)

reason for deprecated rank

14 October 2016

CAS Registry Number

171599-76-1

applies to other chemical entity

0 references

1 reference

DSSTOX compound identifier

2-[(1Z)-1-Octen-1-yl]succinic acid (English)

14 October 2016

1 reference

26 December 2021

1 reference

0 references

0 references

1 reference

(1Z)-1-octenylsuccinic acid (English)