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Ethane, 1,2-bis(beta-(beta-naphthoxy)ethylthio)-

HCID 45575
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Basic information

CAS
63938-34-1
Standard SMILES
c1ccc2cc(OCCSCCSCCOc3ccc4ccccc4c3)ccc2c1
InChIKey
MGMKTHZAZTYTRH-UHFFFAOYSA-N
Molecular formula
C26H26O2S2
Average molar mass
434.6 g/mol
Monoisotopic mass
434.13742241

Names & identifiers

Preferred name
Ethane, 1,2-bis(beta-(beta-naphthoxy)ethylthio)-
IUPAC
2-[2-[2-(2-naphthalen-2-yloxyethylsulfanyl)ethylsulfanyl]ethoxy]naphthalene
English name
1,2-Bis[2-(2-naphthoxy)ethylthio]ethane
Molecular formula
C26H26O2S2
Molecular weight
434.61

Names & synonyms

63938-34-1ETHANE, 1,2-BIS(beta-(beta-NAPHTHOXY)ETHYLTHIO)-1,2-Bis(beta-(beta-naphthoxy)ethylthio)ethaneDTXSID90213768RefChem:339988DTXCID201362591,2-Bis[2-(2-naphthoxy)ethylthio]ethaneDB-2157692,2'-[Ethane-1,2-diylbis(sulfanediylethane-2,1-diyloxy)]dinaphthaleneNaphthalene, 2,2'-[1,2-ethanediylbis(thio-2,1-ethanediyloxy)]bis- (9CI)2-[2-[2-(2-naphthalen-2-yloxyethylsulfanyl)ethylsulfanyl]ethoxy]naphthalene

Database identifiers

CAS
63938-34-1
PubChem CID
45575
DTXSID
DTXSID90213768
Nikkaji
J71.395C

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
69.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
30
Formal charge
0
Complexity
432

Related reactions

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Compound notes

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