2-(3-chloro-2-oxopropyl)-2,3-dihydro-1H-isoindole-1,3-dione
Basic information
- CAS
35750-02-8- Standard SMILES
O=C(CCl)CN1C(=O)c2ccccc2C1=O- InChIKey
GUEXBHONHJVHTM-UHFFFAOYSA-N- Molecular formula
- C11H8ClNO3
- Average molar mass
- 237.64 g/mol
- Monoisotopic mass
- 237.0192708
Names & identifiers
- Preferred name
- 2-(3-chloro-2-oxopropyl)-2,3-dihydro-1H-isoindole-1,3-dione
- IUPAC
- 2-(3-chloro-2-oxopropyl)isoindole-1,3-dione
- English name
- 1-Chloro-3-phthalimido-2-propanone
- Molecular formula
- C11H8ClNO3
- Molecular weight
- 237.64
Names & synonyms
2-(3-chloro-2-oxopropyl)-2,3-dihydro-1H-isoindole-1,3-dioneRefChem:455326992-095-935750-02-82-(3-Chloro-2-oxopropyl)isoindoline-1,3-dione2-(3-chloro-2-oxopropyl)isoindole-1,3-dioneN-(3-Chloro-2-oxoprop-1-yl)phthalimide2-(3-chloro-2-oxopropyl)-1H-isoindole-1,3(2H)-dione1-CHLORO-3-PHTHALIMIDO-2-PROPANONE1h-isoindole-1,3(2h)-dione, 2-(3-chloro-2-oxopropyl)-N-(3-CHLORO-2-OXOPROPYL)PHTHALIMIDENSC11750
Show more names
NSC 11750N-(3-CHLORO-2-OXOPROPYL) PHTHALIMIDE2-(3-Chloro-2-oxoprop-1-yl)-1H-isoindole-1,3(2H)-dione
SCHEMBL7437619SCHEMBL30295614DTXSID60279215NSC-11750STK729386AKOS005528456SB65495CS-0159057
Database identifiers
- CAS
35750-02-8- PubChem CID
- 223787
- DTXSID
DTXSID60279215- EC Number
- 992-095-9
- Nikkaji
- J2.026.509D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 318
Physicochemical properties
- Melting point
- 138 ℃ · 138℃
- Boiling point
- 380 · 380.0±22.0 °C(Predicted)
- Density
- 1.438 · 1.438
- storage temp.
- 2 · 2-8°C
- pka
- -2.56 · -2.56±0.20(Predicted)
- HS Code
- 2925199590 · 2925199590
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
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2925199590
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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