Basic information
- CAS
97-29-0- Standard SMILES
Oc1ccc(Sc2ccc(O)cc2O)c(O)c1- InChIKey
WEMYXYMZQRSPIA-UHFFFAOYSA-N- Molecular formula
- C12H10O4S
- Average molar mass
- 250.27 g/mol
- Monoisotopic mass
- 250.02997997
Names & identifiers
- Preferred name
- 4,4'-Thiodiresorcinol
- IUPAC
- 4-(2,4-dihydroxyphenyl)sulfanylbenzene-1,3-diol
- English name
- Resorcinol sulfide
- Molecular formula
- C12H10O4S
- Molecular weight
- 250.27
Names & synonyms
97-29-04,4'-Thiodiresorcinol2,2',4,4'-Tetrahydroxydiphenyl sulfide4,4'-Thiobis(resorcinol)1,3-Benzenediol, 4,4'-thiobis-Bis(2,4-dihydroxyphenyl) sulfide4,4'-Diresorcyl sulfide2,4-Dihydroxyphenyl sulfideNSC 598284,4'-Thiodibenzene-1,3-diolResorcinol, 4,4'-thiodi-2,2',4,4'-Tetrahydroxydiphenyl thioether
Show more names
THIOBISRESORCINOLRESORCINOL SULFIDEDIRESORCINOL SULFIDEResorcinol sulfide,96%4,4'-Thiodiresorcinol,GprResorcinol Sulfide (>80%)
U2M09JWG5REINECS 202-570-8NSC-59828DTXSID90377472,2',4,4'-TETRAHYDROXYBIPHENYL SULFIDERefChem:506902DTXCID7017747Resorcinol, 4,4'-thiodi-(8CI)
Database identifiers
- CAS
97-29-0- PubChem CID
- 66802
- DTXSID
DTXSID9037747- ChEMBL
CHEMBL473536- UNII
- U2M09JWG5R
- EC Number
- 202-570-8
- Nikkaji
- J60.260D
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 227
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 173 · 173-177 °C
- Boiling point
- 363.4 °C · 363.4°C (rough estimate)
- Density
- 1.4042 · 1.4042 (rough estimate)
- refractive index
- 1.522 · 1.5220 (estimate)
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 8.23 · 8.23±0.40(Predicted)
- color
- Pale Orange to Light Brown
- CAS DataBase Reference
- 97 · 97-29-0(CAS DataBase Reference)
- FDA UNII
- 2 M09JWG5R · U2M09JWG5R
- EPA Substance Registry System
- 1 · 1,3-Benzenediol, 4,4'-thiobis- (97-29-0)
- Symbol(GHS)
- 7 · GHS07
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: 1,3-Benzenediol, 4,4'-thiobis-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 24/25-36-26
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,3-Benzenediol, 4,4'-thiobis-: INACTIVE
Applications
UsesResorcinol Sulfide is used in preparation of rosin resin for acrylate pressure-sensitive adhesive.
Suppliers35 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
南京维奥化工有限公司Please Send Email 18652950785 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
烟台东方化学有限公司+86 532 68629711 137 8060 5697 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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