Basic information
- CAS
6613-64-5- Standard SMILES
C=Cc1cccc[n+]1CCCS(=O)(=O)[O-]- InChIKey
DNHDSWZXBHTLDP-UHFFFAOYSA-N- Molecular formula
- C10H13NO3S
- Average molar mass
- 227.28 g/mol
- Monoisotopic mass
- 227.06161445
Names & identifiers
- Preferred name
- 1-(3-Sulfonatopropyl)-2-vinylpyridinium
- IUPAC
- 3-(2-ethenylpyridin-1-ium-1-yl)propane-1-sulfonate
- English name
- 1-(3-SULFOPROPYL)-2-VINYLPYRIDINIUM BETAINE
- Molecular formula
- C10H13NO3S
- Molecular weight
- 227.28
Names & synonyms
6613-64-51-(3-Sulphonatopropyl)-2-vinylpyridinium3-(2-vinylpyridinium-1-yl)propane-1-sulfonate1-(3-Sulfonatopropyl)-2-vinylpyridiniumNH2H8VRY6LEINECS 229-565-3DTXSID60216327RefChem:424129DTXCID60138818229-565-31-(3-SULFOPROPYL)-2-VINYLPYRIDINIUM BETAINE3-(2-vinylpyridin-1-ium-1-yl)propane-1-sulfonate
Show more names
SPV1-(3-SULFOPROPYL)-2-VINYLPYRIDINIUM HYDROXIDE, INNER SALTPyridine, 2-ethenyl-, reaction products with 1,2-oxathiolane 2,2-dioxide
3-(2-ethenylpyridin-1-ium-1-yl)propane-1-sulfonateMFCD000806432-ethenyl-1-(3-sulfonatopropyl)pyridin-1-ium1-(3-Sulfopropyl)-2-vinylpyridinium hydroxide inner saltSCHEMBL181489981-(3-Sulfopropyl-1)-2-vinyl pyridinium betaine3-(2-ethenylpy90552-35-5
Database identifiers
- CAS
6613-64-5、90552-35-5- PubChem CID
- 81089
- DTXSID
DTXSID60216327- UNII
- NH2H8VRY6L
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 69.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 281
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 25% (1 of 4) of reports.
Warning
H302 (75%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 4 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationREACH registered substance: 1-(3-sulphonatopropyl)-2-vinylpyridinium (EC: 229-565-3)
Hazard Classes and CategoriesAcute Tox. 4 (75%)
Chemistry & industry
Suppliers37 total
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Wuhan Bright Chemical Co., Ltd+86-02785804899 +86-15071395570 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
淄博容纳生物科技有限公司+86-86-13583358881 +8618560316533 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海阿拉丁生化科技股份有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…