Basic information
- CAS
3021-31-6- Standard SMILES
CC(C)(C)c1ccc(OC2CCCCC2OS(=O)Cl)cc1- InChIKey
WAAUJYWIXWENKQ-UHFFFAOYSA-N- Molecular formula
- C16H23ClO3S
- Average molar mass
- 330.9 g/mol
- Monoisotopic mass
- 330.10564328
Names & identifiers
- Preferred name
- Chlorosulfurous acid, 2-(p-t-butylphenoxy)cyclohexyl ester
- IUPAC
- 1-tert-butyl-4-(2-chlorosulfinyloxycyclohexyl)oxybenzene
- English name
- 2-(p-tert-butylphenoxy)cyclohexyl chlorosulphite
- Molecular formula
- C16H23ClO3S
- Molecular weight
- 330.87
Names & synonyms
3021-31-6HSDB 5911EINECS 221-170-4Chlorosulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl esterDTXSID20883938Chlorosulfurous acid, 2-(p-t-butylphenoxy)cyclohexyl esterChlorosulfurous acid, 2-(p-tert-butylphenoxy)cyclohexyl esterChlorosulfurous acid, 2-(4-(1,1-dimethylethyl)phenoxy)cyclohexyl esterRefChem:125522DTXCID0010234152(ptertButylphenoxy)cyclohexyl chlorosulphiteChlorosulfurous acid, 2(ptertbutylphenoxy)cyclohexyl ester
Show more names
2-(p-tert-Butylphenoxy)cyclohexyl chlorosulfite1-tert-butyl-4-(2-chlorosulfinyloxycyclohexyl)oxybenzeneChloridosulfurous acid 2-(p-tert-butylphenoxy)cyclohexyl ester
Chlorosulfurous acid, 2(4(1,1dimethylethyl)phenoxy)cyclohexyl ester2-(p-tert-Butylphenoxy)cyclohexyl chlorosulphiteSCHEMBL27854805WAAUJYWIXWENKQ-UHFFFAOYSA-NNS000483242-(4-tert-Butylphenoxy)cyclohexyl sulfurochloridoite
Database identifiers
- CAS
3021-31-6- PubChem CID
- 18183
- DTXSID
DTXSID20883938- EC Number
- 221-170-4
- Nikkaji
- J205.325J
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 348
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Other Aromatic Compounds
Physicochemical properties
- EPA Substance Registry System
- 2 · Chlorosulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl ester (3021-31-6)
- TSCA
- TSCA listed
- Hazardous Substances Data
- 3021 · 3021-31-6(Hazardous Substances Data)
Safety & regulation
Safety data
- tsca
- TSCA listed
- Hazardous Substances Data
- 3021-31-6(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationChlorosulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl ester: INACTIVE
Suppliers2 total
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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