Basic information
- CAS
19116-90-6- Standard SMILES
COc1ccc(OC)c(S(N)(=O)=O)c1- InChIKey
MMHMYFWOECSGDR-UHFFFAOYSA-N- Molecular formula
- C8H11NO4S
- Average molar mass
- 217.24 g/mol
- Monoisotopic mass
- 217.04087883
Names & identifiers
- Preferred name
- Benzenesulfonamide, 2,5-dimethoxy-
- IUPAC
- 2,5-dimethoxybenzenesulfonamide
- English name
- 2,5-DIMETHOXYBENZENESULFONAMIDE
- Molecular formula
- C8H11NO4S
- Molecular weight
- 217.24
Names & synonyms
2,5-DimethoxybenzenesulfonamideBenzenesulfonamide, 2,5-dimethoxy-BRN 2648546AI3-17891DTXSID201726373-11-00-00570 (Beilstein Handbook Reference)RefChem:325219DTXCID009512819116-90-62,5-dimethoxybenzenesulphonamide2,5-dimethoxybenzene-1-sulfonamideMFCD00833415
Show more names
2,5-dimethoxy-benzenesulfonamid
MLS0000645072,5-dimethoxyphenylsulfonamideSCHEMBL1137736SCHEMBL5943967CHEMBL1547606SCHEMBL29406781MMHMYFWOECSGDR-UHFFFAOYSA-NHMS1594F02
Database identifiers
- CAS
19116-90-6- PubChem CID
- 209044
- DTXSID
DTXSID20172637- ChEMBL
CHEMBL1547606- Nikkaji
- J3.307.123J
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Melting point
- 150 °C · 150 °C
- form
- crystalline solid
- color
- White
- CAS DataBase Reference
- 19116 · 19116-90-6(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
- Hazard Codes
- Xi
- RTECS
- 2030000 · DB2030000
- HazardClass
- IRRITANT
- HS Code
- 2935909099 · 2935909099
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
- rtecs
- DB2030000
- hs_code
- 2935909099
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Chemistry & industry
Suppliers14 total
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
杭州陶瑞生物科技有限公司QQ1259737804 15268198094 · [email protected]
重庆卡兰医药有限公司[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
JACS-郑州杰克斯化工产品有限公司0371-86259281 13223061139 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
6 records
Compound notes
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