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Basic information
- CAS
211501-36-9- Standard SMILES
CC(CO)N1C(=O)c2ccccc2C1=O- InChIKey
KYTIHOIDWMVRKU-UHFFFAOYSA-N- Molecular formula
- C11H11NO3
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.07389321
Names & identifiers
- Preferred name
- 2-(2-Hydroxy-1-methylethyl)-1H-isoindole-1,3(2H)-dione
- IUPAC
- 2-(1-hydroxypropan-2-yl)isoindole-1,3-dione
- English name
- 2-(2-Hydroxy-1-methylethyl)-1H-isoindole-1,3(2H)-dione
- Molecular formula
- C11H11NO3
- Molecular weight
- 205.21
Names & synonyms
211501-36-92-(2-Hydroxy-1-methylethyl)-1H-isoindole-1,3(2H)-dioneDTXSID30344863RefChem:250715DTXCID402959382-(1-Hydroxypropan-2-yl)isoindoline-1,3-dione2-(1-hydroxypropan-2-yl)isoindole-1,3-dioneMFCD090379972-(2-Hydroxy-1-methylethyl)-1H-isoindole-1,3(2H)-dione;Phthalimide, N-(1-hydroxy-2-propyl)-2-phthalimido-1-propanolSCHEMBL5194206
Show more names
2-(2-Hydroxy-1-methylethyl)-1H-isoindol-1,3(2H)-dione1H-Isoindole-1,3(2H)-dione, 2-(2-hydroxy-1-methylethyl)-
SCHEMBL27755640SCHEMBL308057932-(1-hydroxypropan-2-yl)-2,3-dihydro-1H-isoindole-1,3-dioneYCA32391AKOS005142377SB46612SB65723SB65829
Database identifiers
- CAS
211501-36-9- PubChem CID
- 600020
- DTXSID
DTXSID30344863- Nikkaji
- J1.243.487A
Properties
Computed structural propertiesFilling in
- XLogP
- 1.1
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 266
Physicochemical properties
- Melting point
- 99 · 99-101℃
- Boiling point
- 357 ℃ · 357℃
- Density
- 1.348 · 1.348
- Flash point
- 170 ℃ · 170℃
- solubility
- Chloroform; Methanol; DMSO
- form
- Solid
- color
- Beige
Chemistry & industry
Applications
Uses2-(1-Hydroxypropan-2-yl)isoindoline-1,3-dione is an intermediate in the synthesis of m-Hydroxy Mexiletine (H939030), a metabolite of Mexiletine (M340800), a class Ib antiarrhythmic drug.
Suppliers4 total
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海信旗医药科技有限公司+86-21-54098501 · [email protected]
Related reactions
9 records
Compound notes
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