4,7,14,17-tetraoxa-10,11-dithiaicosanedioic acid

4,7,14,17-tetraoxa-10,11-dithiaicosanedioic acid

CAS: 1807539-10-1

Formula: C14H26O8S2

SMILES: OC(=O)CCOCCOCCSSCCOCCOCCC(O)=O

IUPAC: 4,7,14,17-tetraoxa-10,11-dithiaicosanedioic acid

InChI: InChI=1S/C14H26O8S2/c15-13(16)1-3-19-5-7-21-9-11-23-24-12-10-22-8-6-20-4-2-14(17)18/h1-12H2,(H,15,16)(H,17,18)

Composition: C (43.51%), H (6.78%), O (33.12%), S (16.59%)

Molar Mass: 386.47

Atom Count: 50

Heavy Atom Count: 24

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	386.106910145
Formal Charge	0
FSP3	0.86
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	2
InChIKey	TZKZHEPGHNBGKD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	93.05
Topological Polar Surface Area	111.52
Polarizability	36.69
Ring Count	0
Rotatable Bond Count	19

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