Basic information
- CAS
56048-52-3- Standard SMILES
CC(C)(C)c1ccc(-c2nc3ccccc3s2)cc1- InChIKey
RBKGJKUWWDNBNT-UHFFFAOYSA-N- Molecular formula
- C17H17NS
- Average molar mass
- 267.4 g/mol
- Monoisotopic mass
- 267.10817072
Names & identifiers
- Preferred name
- 2-(4-Tert-butylphenyl)-1,3-benzothiazole
- IUPAC
- 2-(4-tert-butylphenyl)-1,3-benzothiazole
- English name
- 2-(4-tert-Butyl-phenyl)-benzothiazole
- Molecular formula
- C17H17NS
- Molecular weight
- 267.39
Names & synonyms
2-(4-tert-butylphenyl)-1,3-benzothiazole56048-52-3DTXSID60351782RefChem:252830DTXCID903028482-(4-TERT-BUTYL-PHENYL)-BENZOTHIAZOLEMLS-0412171.0001HMS1549I192-(4-tert-Butylphenyl)benzothiazoleTimTec1_005475cid_709072SCHEMBL5598274
Show more names
2-(p-tert-Butylphenyl)benzothiazole2-[4-(1,1-Dimethylethyl)phenyl]benzothiazoleBenzothiazole, 2-[4-(1,1-dimethylethyl)phenyl]-
CHEMBL1699128SCHEMBL13118015BDBM62265RBKGJKUWWDNBNT-UHFFFAOYSA-NSTK299594AKOS0017064252-[4-(tert-butyl)phenyl]benzothiazole2-(4-(t-butyl)phenyl)benzo[d]thiazole
Database identifiers
- CAS
56048-52-3- PubChem CID
- 709072
- DTXSID
DTXSID60351782- ChEMBL
CHEMBL1699128- Nikkaji
- J347.911K
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 301
Chemistry & industry
Suppliers2 total
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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