(11Z)-1-oxacyclododec-11-en-3-one

C11H18O2 — CID 155759290

IUPAC(11Z)-1-oxacyclododec-11-en-3-one
SMILESO=C1CCCCCCC/C=C\OC1
InChIInChI=1S/C11H18O2/c12-11-8-6-4-2-1-3-5-7-9-13-10-11/h7,9H,1-6,8,10H2/b9-7-
InChIKeyRLSSLZPOKZBXPP-CLFYSBASSA-N
MW182.26 g/mol
LogP2.83
Rot. Bonds

About (11Z)-1-oxacyclododec-11-en-3-one

(11Z)-1-oxacyclododec-11-en-3-one (PubChem CID 155759290) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is (11Z)-1-oxacyclododec-11-en-3-one.

Molecular Properties

Compound Name(11Z)-1-oxacyclododec-11-en-3-one
PubChem CID155759290
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name(11Z)-1-oxacyclododec-11-en-3-one
SMILESO=C1CCCCCCC/C=C\OC1
InChIInChI=1S/C11H18O2/c12-11-8-6-4-2-1-3-5-7-9-13-10-11/h7,9H,1-6,8,10H2/b9-7-
InChIKeyRLSSLZPOKZBXPP-CLFYSBASSA-N
XLogP2.83
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2Z)-1-oxacyclohexadec-2-en-4-one
CID 90000456
Epoxy methyl 10-undecenoate
CID 163362437
1-(2,2,2-Trifluoroethoxy)non-8-en-2-one
CID 107008459
1-(2,2,3,3-Tetrafluoropropoxy)non-8-en-2-one
CID 107008460
2-Decylpyran-3,4-dione
CID 21397286
2-Hexylpyran-3,4-dione
CID 21397291
2-Heptylpyran-3,4-dione
CID 21397303
2-Nonylpyran-3,4-dione
CID 21397304
Ethyl 2-oxonon-8-enoate
CID 55269419
(11Z)-1-oxacyclohexadec-11-en-3-one
CID 66643319
(11E)-1-oxacyclohexadec-11-en-3-one
CID 66643320
1-Oxacyclohexadec-11-en-3-one
CID 66643321

Frequently Asked Questions

What is the IUPAC name of (11Z)-1-oxacyclododec-11-en-3-one?
The IUPAC name of (11Z)-1-oxacyclododec-11-en-3-one (CID 155759290) is (11Z)-1-oxacyclododec-11-en-3-one.
What is the SMILES notation for (11Z)-1-oxacyclododec-11-en-3-one?
The canonical SMILES for (11Z)-1-oxacyclododec-11-en-3-one is O=C1CCCCCCC/C=C\OC1.
What is the InChIKey of (11Z)-1-oxacyclododec-11-en-3-one?
The InChIKey is RLSSLZPOKZBXPP-CLFYSBASSA-N. The full InChI is InChI=1S/C11H18O2/c12-11-8-6-4-2-1-3-5-7-9-13-10-11/h7,9H,1-6,8,10H2/b9-7-.
What are the key properties of (11Z)-1-oxacyclododec-11-en-3-one?
(11Z)-1-oxacyclododec-11-en-3-one has a molecular weight of 182.26 g/mol, XLogP of 2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (11Z)-1-oxacyclododec-11-en-3-one is sourced from PubChem (CID 155759290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).