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Disulfide, 1,2-di-2-naphthalenyl

HCID 79697
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5586-15-2
Standard SMILES
c1ccc2cc(SSc3ccc4ccccc4c3)ccc2c1
InChIKey
SUPMWVVVBKKGEL-UHFFFAOYSA-N
Molecular formula
C20H14S2
Average molar mass
318.5 g/mol
Monoisotopic mass
318.05369279

Names & identifiers

Preferred name
Disulfide, 1,2-di-2-naphthalenyl
IUPAC
2-(naphthalen-2-yldisulfanyl)naphthalene
English name
Di-2-naphthyldisulphide
Molecular formula
C20H14S2
Molecular weight
318.46

Names & synonyms

Di-2-Naphthyl disulfideDisulfide, di-2-naphthalenylDi-beta-naphthyl disulfideDisulfide, 1,2-di-2-naphthalenylNSC 97427RefChem:5897912-Naphthyl disulfide5586-15-22-(naphthalen-2-yldisulfanyl)naphthaleneDI-2-NAPHTHYLDISULPHIDEDi-.beta.-naphthyl disulfide595W3H3HK3
Show more names
2-Nathphalenyl disulfide2,2'-DithiobisnaphthaleneDi(2-naphthyl) persulfideBis(2-naphthyl) persulfide2,2'-Dithiobis(naphthalene)Bis(2-naphthalenyl) persulfide
NSC-97427NSC6774772-Naphthyldisulfidebis(2-naphthyl)disulfide2,2'-DithiodinaphthaleneSCHEMBL225296UNII-595W3H3HK3CHEMBL333712

Database identifiers

CAS
5586-15-2
PubChem CID
79697
DTXSID
DTXSID60871137
ChEMBL
CHEMBL333712
UNII
595W3H3HK3
EC Number

Properties

Computed structural properties

XLogP
6.5
Topological polar surface area
50.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
322

Physicochemical properties

Melting point
139.5 °C · 139.5°C
Boiling point
417.61 °C · 417.61°C (rough estimate)
Density
1.2912 · 1.2912 (rough estimate)
refractive index
1.4555 · 1.4555 (estimate)
FDA UNII
595 W3H3HK3 · 595W3H3HK3
EPA Substance Registry System
-2 · Disulfide, di-2-naphthalenyl (5586-15-2)
Hazard statements
413 · H413
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 3 items

H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]

P273, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAquatic Chronic 4 (100%)

Safety data

tsca
TSCA listed
Hazard statements
H413

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationDisulfide, 1,2-di-2-naphthalenyl: INACTIVE

Suppliers6 total

江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
南京大唐医药科技有限公司025-84341491 13951930983 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
河南阿尔法化工有限公司0371-55051623 18137891487 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
CD Chemical Group Limited+86-13651442114 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
635-239-5
Nikkaji
J421.776D