2-[bis(2-hydroxyethyl)amino]ethyl (9Z)-octadec-9-enoate

2-[bis(2-hydroxyethyl)amino]ethyl (9Z)-octadec-9-enoate

CAS: 10277-04-0

Formula: C24H47NO4

SMILES: CCCCCCCCC=C/CCCCCCCC(=O)OCCN(CCO)CCO

IUPAC: 2-[bis(2-hydroxyethyl)amino]ethyl (9Z)-octadec-9-enoate

InChI: InChI=1S/C24H47NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24(28)29-23-20-25(18-21-26)19-22-27/h9-10,26-27H,2-8,11-23H2,1H3/b10-9-

Composition: C (69.69%), H (11.45%), N (3.39%), O (15.47%)

Molar Mass: 413.643

Atom Count: 76

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	413.350508997
Formal Charge	0
FSP3	0.87
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	FTJUZCBLWZLXFR-KTKRTIGZSA-N
Lipinski's Rule of Five
Molar Refractivity	122.77
Topological Polar Surface Area	70
Polarizability	48.22
Ring Count	0
Rotatable Bond Count	23

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