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Substance Name: Behenyl erucate
RN: 18312-32-8
UNII: 681898L9A8
InChIKey: MQSDOCWFPKXZGN-ZZEZOPTASA-N

Molecular Formula

  • C44-H86-O2

Molecular Weight

  • 647.161
 
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Names and Synonyms

Name of Substance

  • 13-Docosenoic acid, docosyl ester
  • Behenyl erucate
  • Docosyl 13-docosenoate

Synonyms

  • EINECS 242-201-8
  • UNII-681898L9A8

Systematic Name

  • Docosyl (Z)-docos-13-enoate

Registry Numbers

CAS Registry Number

  • 18312-32-8

FDA UNII

  • 681898L9A8

System Generated Number

  • 0018312328

Structure Descriptors

InChI

1S/C44H86O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-46-44(45)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20H,3-17,19,21-43H2,1-2H3/b20-18-

InChIKey

MQSDOCWFPKXZGN-ZZEZOPTASA-N

Smiles

C(\CCCCCCCC)=C/CCCCCCCCCCCC(=O)OCCCCCCCCCCCCCCCCCCCCCC