Basic information
- CAS
5605-46-9- Standard SMILES
Cc1ccc(S(=O)(=O)N2C[C@H](O)C[C@H]2CO)cc1- InChIKey
RBSLQBNFZCEBJT-WDEREUQCSA-N- Molecular formula
- C12H17NO4S
- Average molar mass
- 271.33 g/mol
- Monoisotopic mass
- 271.08782902
Names & identifiers
- Preferred name
- (3R,5S)-5-(hydroxymethyl)-1-tosylpyrrolidin-3-ol
- IUPAC
- (3R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonylpyrrolidin-3-ol
- English name
- (3R,5S)-5-(hydroxymethyl)-1-tosylpyrrolidin-3-ol
- Molecular formula
- C12H17NO4S
- Molecular weight
- 271.33
Names & synonyms
(3R,5S)-5-(hydroxymethyl)-1-tosylpyrrolidin-3-ol5605-46-9(3R,5S)-5-(hydroxymethyl)-1-(4-methylphenyl)sulfonylpyrrolidin-3-olorb3021604SCHEMBL9211270DTXSID40460604RBSLQBNFZCEBJT-WDEREUQCSA-NTYD-02416AKOS000279979DB-344688(2S, 4R)-2-Hydroxymethyl-4-hydroxy-1-(4-toluenesulfonyl)-pyrrolidine(2S,4R)-1-(4-toluenesulfonyl)-2-hydroxymethyl-4-hydroxy pyrrolidine
Show more names
RMA-68914002-2SN-Tosylhydroxy-L-prolinol(3R)-5-(hydroxyMethyl)-1-tosylpyrrolidin-3-oltrans-(-)-4-Hydroxy-1-(p-tolylsulfonyl)pyrrolidine-2-methanol(2S,4R)-4-Hydroxy-1-[(4-methylphenyl)sulfonyl]pyrrolidine-2-...(3R,5S)-5-(hydroxymethyl)-1- tosylpyrrolidin-3-ol (Intermediate)(2S,4R)-4-Hydroxy-1-[(4-methylphenyl)sulfonyl]pyrrolidine-2-methanol(2S,4R)-4-Hydro×y-1-[(4-Methylphenyl)sulfonyl]pyrrolidine-2-Methanol
(3R,5S)-5-(Hydroxymethyl)-1-(4-methylbenzene-1-sulfonyl)pyrrolidin-3-ol(3R,5S)-5-(hydroxymethyl)-1-[(4-methylphenyl)sulfonyl]-3-pyrrolidinol
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 86.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 370
Physicochemical properties
- Melting point
- 132 · 132-133℃
- Density
- 1.364 · 1.364
- storage temp.
- 2 · 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers29 total
普洛药业股份有限公司/浙江横店普洛进出口有限公司+86-0571-87635730 +86-13588737631
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
常州市华阳科技有限公司+8615250961469 · [email protected]
郑州凡尔赛特化工有限公司0371-67991738 13783628208
上海升华医药科技有限公司021-50793966 18917198199
Apeloa Pharmaceutical Co., Ltd.+86-0571-87635730 +8615858229168 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
赛纳斯特化学（欢迎点击联系）021-60343070
南京博济达医药科技有限公司18762407961 · [email protected]
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sgtlifesciences pvt ltd+91-8790379245 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Related reactions
3 records
Compound notes
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