(Q82006663)

English

1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)

chemical compound

1,1'-{Propane-2,2-diylbis[(4,1-phenylene)oxy]}bis(3-sulfanylpropan-2-ol)

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instance of

type of chemical entity

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subclass of

chemical compound

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mass

408.14290137599994 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₁H₂₈O₄S₂

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C)(c1ccc(OCC(O)CS)cc1)c1ccc(OCC(O)CS)cc1

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI

InChI=1S/C21H28O4S2/c1-21(2,15-3-7-19(8-4-15)24-11-17(22)13-26)16-5-9-20(10-6-16)25-12-18(23)14-27/h3-10,17-18,22-23,26-27H,11-14H2,1-2H3

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InChIKey

OLPTYESEXWLOCS-UHFFFAOYSA-N

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CAS Registry Number

30805-93-7

reason for deprecated rank

cannot be confirmed by other sources

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29953-09-1

1 reference

InChIKey

OLPTYESEXWLOCS-UHFFFAOYSA-N

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=29953-09-1

2 references

26 December 2021

matched by identifier from

InChIKey

OLPTYESEXWLOCS-UHFFFAOYSA-N

1 reference

1 reference

matched by identifier from

InChIKey

OLPTYESEXWLOCS-UHFFFAOYSA-N

DTXSID10952384

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matched by identifier from

InChIKey

OLPTYESEXWLOCS-UHFFFAOYSA-N

DSSTOX compound identifier

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(Q82006663)

1,1'-(Isopropylidenebis(p-phenyleneoxy))bis(3-mercaptopropan-2-ol)

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