1,4-Bis(acetyloxy)-3-(dodecylsulfanyl)-2-naphthyl acetate

HCID 536635

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Basic information

CAS: 41565-78-0
Standard SMILES: CCCCCCCCCCCCSc1c(OC(C)=O)c(OC(C)=O)c2ccccc2c1OC(C)=O
InChIKey: NENJPBSAVITEEW-UHFFFAOYSA-N
Molecular formula: C28H38O6S
Average molar mass: 502.7 g/mol
Monoisotopic mass: 502.2389101

Names & identifiers

Preferred name: 1,4-Bis(acetyloxy)-3-(dodecylsulfanyl)-2-naphthyl acetate
IUPAC: (2,4-diacetyloxy-3-dodecylsulfanylnaphthalen-1-yl) acetate
English name: 1,4-Bis(acetyloxy)-3-(dodecylsulfanyl)-2-naphthyl acetate
Molecular formula: C28H38O6S
Molecular weight: 0

Names & synonyms

41565-78-01,4-Bis(acetyloxy)-3-(dodecylsulfanyl)-2-naphthyl acetateDTXSID60336832RefChem:220203DTXCID50287920NENJPBSAVITEEW-UHFFFAOYSA-N1,2,4-Triacetoxy-3-dodecylmercaptonaphthalene3-(Dodecylsulfanyl)naphthalene-1,2,4-triyl triacetate1,4-Bis(acetyloxy)-3-(dodecylsulfanyl)-2-naphthyl acetate #Reaxys ID: 2609427

Database identifiers

CAS: 41565-78-0
PubChem CID: 536635
DTXSID: DTXSID60336832

Properties

Computed structural properties

XLogP: 8.5
Topological polar surface area: 104 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 7
Rotatable bonds: 18
Heavy atoms: 35
Formal charge: 0
Complexity: 653

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

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