2,3-bis(hexadecyloxy)propan-1-ol

2,3-bis(hexadecyloxy)propan-1-ol

CAS: 13071-60-8

Formula: C35H72O3

SMILES: CCCCCCCCCCCCCCCCOCC(CO)OCCCCCCCCCCCCCCCC

IUPAC: 2,3-bis(hexadecyloxy)propan-1-ol

InChI: InChI=1/C35H72O3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-34-35(33-36)38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36H,3-34H2,1-2H3

Composition: C (77.71%), H (13.42%), O (8.87%)

Molar Mass: 540.958

Atom Count: 110

Heavy Atom Count: 38

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	540.548146178
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	YQDJMFFVPVZWNK-UHFFFAOYNA-N
Lipinski's Rule of Five
Molar Refractivity	168.19
Topological Polar Surface Area	38.69
Polarizability	67.25
Ring Count	0
Rotatable Bond Count	34

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