6-prop-2-enoyloxydodecyl prop-2-enoate

C18H30O4 — CID 151920559

IUPAC6-prop-2-enoyloxydodecyl prop-2-enoate
SMILESC=CC(=O)OCCCCCC(CCCCCC)OC(=O)C=C
InChIInChI=1S/C18H30O4/c1-4-7-8-10-13-16(22-18(20)6-3)14-11-9-12-15-21-17(19)5-2/h5-6,16H,2-4,7-15H2,1H3
InChIKeySWRKDOYJZRXHGY-UHFFFAOYSA-N
MW310.43 g/mol
LogP4.34
Rot. Bonds14

About 6-prop-2-enoyloxydodecyl prop-2-enoate

6-prop-2-enoyloxydodecyl prop-2-enoate (PubChem CID 151920559) has the molecular formula C18H30O4 and a molecular weight of 310.43 g/mol. Its IUPAC name is 6-prop-2-enoyloxydodecyl prop-2-enoate.

Molecular Properties

Compound Name6-prop-2-enoyloxydodecyl prop-2-enoate
PubChem CID151920559
Molecular FormulaC18H30O4
Molecular Weight310.43 g/mol
Exact Mass310.21
IUPAC Name6-prop-2-enoyloxydodecyl prop-2-enoate
SMILESC=CC(=O)OCCCCCC(CCCCCC)OC(=O)C=C
InChIInChI=1S/C18H30O4/c1-4-7-8-10-13-16(22-18(20)6-3)14-11-9-12-15-21-17(19)5-2/h5-6,16H,2-4,7-15H2,1H3
InChIKeySWRKDOYJZRXHGY-UHFFFAOYSA-N
XLogP4.34
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.43
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

heptadecan-8-yl prop-2-enoate
CID 121420657
octadecan-6-yl prop-2-enoate
CID 91523695
tridecan-5-yl prop-2-enoate
CID 141073146
pentadecan-4-yl prop-2-enoate
CID 543287
docosyl prop-2-enoate;henicosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 161245650
hexyl prop-2-enoate
CID 17259
docosyl prop-2-enoate;henicosyl prop-2-enoate;icosyl prop-2-enoate;tetracosyl prop-2-enoate;tricosyl prop-2-enoate
CID 159127322
pentatriacontyl prop-2-enoate
CID 141309454
heptadecyl prop-2-enoate;hexadecyl prop-2-enoate;octadecyl prop-2-enoate;pentadecyl prop-2-enoate;tetradecyl prop-2-enoate
CID 159699669
decyl prop-2-enoate
CID 162172023
heptadecyl prop-2-enoate;hexadecyl prop-2-enoate;octadecyl prop-2-enoate;pentadecyl prop-2-enoate;tetradecyl prop-2-enoate;tridecyl prop-2-enoate
CID 159575283
6-methyltetradecyl prop-2-enoate
CID 87169125

Frequently Asked Questions

What is the IUPAC name of 6-prop-2-enoyloxydodecyl prop-2-enoate?
The IUPAC name of 6-prop-2-enoyloxydodecyl prop-2-enoate (CID 151920559) is 6-prop-2-enoyloxydodecyl prop-2-enoate.
What is the SMILES notation for 6-prop-2-enoyloxydodecyl prop-2-enoate?
The canonical SMILES for 6-prop-2-enoyloxydodecyl prop-2-enoate is C=CC(=O)OCCCCCC(CCCCCC)OC(=O)C=C.
What is the InChIKey of 6-prop-2-enoyloxydodecyl prop-2-enoate?
The InChIKey is SWRKDOYJZRXHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30O4/c1-4-7-8-10-13-16(22-18(20)6-3)14-11-9-12-15-21-17(19)5-2/h5-6,16H,2-4,7-15H2,1H3.
What are the key properties of 6-prop-2-enoyloxydodecyl prop-2-enoate?
6-prop-2-enoyloxydodecyl prop-2-enoate has a molecular weight of 310.43 g/mol, XLogP of 4.34, 14 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-2-enoyloxydodecyl prop-2-enoate is sourced from PubChem (CID 151920559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).