Registration Dossier
Registration Dossier
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EC number: 422-320-3 | CAS number: - HABANOLIDE
Reference substances
- IUPAC name:
- reaction mass of (12E)-Oxacyclohexadec-12-en-2-one and (12Z)-Oxacyclohexadec-12-en-2-one and (13E)-Oxacyclohexadec-13-en-2-one
Inventory
- EC number:
- 422-320-3
- EC name:
- A mixture of: (E)-oxacyclohexadec-12-en-2-one; (E)-oxacyclohexadec-13-en-2-one; a) (Z)-oxacyclohexadec-(12)-en-2-one and b) (Z)-oxacyclohexadec-(13)-en-2-one
- CAS number:
- -
- Description:
- HABANOLIDE
- CAS number:
- 111879-80-2
Synonyms
- Names:
- Oxacyclohexadecen-2-one
- Identifier:
- IUPAC name
- Oxacyclohexadecen-2-one
- Identifier:
- IUPAC name
- Reaction mass of (E)-oxacyclohexadec-12-en-2-one and (E)-oxacyclohexadec-13-en-2-one and (Z)-oxacyclohexadec-(12)-en-2-one and (Z)-oxacyclohexadec-(13)-en-2-one
- Identifier:
- other: SMILES notation
- C1CCCC\C=C/CCCOC(=O)CCCC1 (12Z) C1CCCC/C=C/CCCOC(=O)CCCC1 (12E) C1CCCCCC(=O)OCC/C=C\CCCC1 (13Z) C1CCCCCC(=O)OCC/C=C/CCCC1 (13E)
- Identifier:
- other: SMILES notation
- not applicable
- Identifier:
- other: InChl
- not applicable
Molecular and structural information
- Molecular formula:
- C15H26O2
- Molecular weight:
- 238.37
- SMILES notation:
- O=C1CCCCCCCCC/C=C\CCCO1
O=C1CCCCCCCCCCC=CCCO1
O=C1CCCCCCCCCC=CCCCO1 - InChl:
- InChI=1S/C15H26O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h6,8H,1-5,7,9-14H2/b8-6+
InChI=1S/C15H26O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h8,10H,1-7,9,11-14H2/b10-8+
InChI=1S/C15H26O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h6,8H,1-5,7,9-14H2/b8-6- - Structural formula:
Related substances
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Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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