Basic information
- CAS
209917-48-6- Standard SMILES
CC(C)(C)NS(=O)(=O)c1ccc(N)cc1- InChIKey
XEJAJZSTMLRDKH-UHFFFAOYSA-N- Molecular formula
- C10H16N2O2S
- Average molar mass
- 228.31 g/mol
- Monoisotopic mass
- 228.09324875
Overview
See also: 4-Amino-N-(terc-butyl)benzenesulfonamide (annotation moved to).
Names & identifiers
- Preferred name
- 4-Amino-N-(1,1-dimethylethyl)benzenesulfonamide
- IUPAC
- 4-amino-N-tert-butylbenzenesulfonamide
- English name
- N-tert-Butyl 4-Aminophenylsulfonamide
- Molecular formula
- C10H16N2O2S
- Molecular weight
- 228.31
Names & synonyms
4-amino-N-(1,1-dimethylethyl)benzenesulfonamideRefChem:518071209917-48-6N-tert-Butyl 4-Aminophenylsulfonamide4-amino-N-tert-butylbenzenesulfonamide4-amino-N-(tert-butyl)benzenesulfonamideN-tert-Butyl-4-aminobenzenesulfonamideMFCD03002128N-t-Butyl 4-aminophenylsulfonamideBenzenesulfonamide, 4-amino-N-(1,1-dimethylethyl)-4-amino-N-tert-butyl-benzenesulfonamide4-amino-N-tert-butylbenzene-1-sulfonamide
Show more names
4-amino-N-tert-butylbenzenesulfonylamide4-Amino-N-(terc-butyl)benzenesulfonamide
[(4-aminophenyl)sulfonyl](tert-butyl)amineN-tert-Butyl4-Aminophenylsulfonamide4-Amino-N-(1,1-dimethylethyl)benzenesulfonamide; 4-Amino-N-tert-butylbenzenesulfonamide2U48PK7Y5RSCHEMBL2408403DTXSID90356780XEJAJZSTMLRDKH-UHFFFAOYSA-NALBB-000044
Database identifiers
- CAS
209917-48-6
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 292
Physicochemical properties
- Melting point
- 128 · 128-130°C
- Boiling point
- 374.8 · 374.8±44.0 °C(Predicted)
- Density
- 1.189 · 1.189±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 12.95 · 12.95±0.50(Predicted)
- color
- White
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H317
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
- REACH Registrations
- Active
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H317
- REACH Registrations
- Active
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Chemistry & industry
Applications
UsesN-tert-Butyl-4-aminobenzenesulfonamide is an synthetic intermediate used in the synthesis of various pharmaceutical goods such as CK2 and PIM kinase inhibitors.
Suppliers65 total
上海康恩博医药科技有限公司17510465506 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
镇江中智化学科技有限公司0511-15050866711; 15050866711 · [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]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Related reactions
13 records
Compound notes
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