octadecyl prop-2-enoate

octadecyl prop-2-enoate

CAS: 4813-57-4

Formula: C21H40O2

SMILES: CCCCCCCCCCCCCCCCCCOC(=O)C=C

IUPAC: octadecyl prop-2-enoate

InChI: InChI=1S/C21H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23-21(22)4-2/h4H,2-3,5-20H2,1H3

Composition: C (77.72%), H (12.42%), O (9.86%)

Molar Mass: 324.549

Atom Count: 63

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	324.302830528
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FSAJWMJJORKPKS-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	100.35
Topological Polar Surface Area	26.3
Polarizability	39.96
Ring Count	0
Rotatable Bond Count	19

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