4-(2,5-Dioxopyrrolidin-1-yl)butanoic acid
Basic information
- CAS
31601-68-0- Standard SMILES
O=C(O)CCCN1C(=O)CCC1=O- InChIKey
SIILHQSLHMQZQO-UHFFFAOYSA-N- Molecular formula
- C8H11NO4
- Average molar mass
- 185.18 g/mol
- Monoisotopic mass
- 185.06880783
Names & identifiers
- Preferred name
- 4-(2,5-Dioxopyrrolidin-1-yl)butanoic acid
- IUPAC
- 4-(2,5-dioxopyrrolidin-1-yl)butanoic acid
- English name
- 4-(2,5-Dioxo-pyrrolidin-1-yl)-butyric acid
- Molecular formula
- C8H11NO4
- Molecular weight
- 185.18
Names & synonyms
4-(2,5-dioxopyrrolidin-1-yl)butanoic acidDTXSID90307550RefChem:510790DTXCID70258677824-808-531601-68-04-(2,5-Dioxo-pyrrolidin-1-yl)-butyric acidMFCD004820012,5-Dioxo-1-pyrrolidinebutanoic acid4-(2,5-Dioxo-1-pyrrolidinyl)butanoic acid4-(2,5-dioxoazolidinyl)butanoic acidNSC192708
Show more names
NSC 192708OTAVA-BB 1113767VITAS-BB TBB002226ART-CHEM-BB B030210UKRORGSYN-BB BBV-035454ASINEX-REAG BAS 095385914-Succinimidobutyric acidgamma-Succinimidobutyric acidN-Succinyl-gamma-aminobutyric acid2,5-Dioxo-1-Pyrrolidinebutanoicacid
1-Pyrrolidinebutanoicacid, 2,5-dioxo-SCHEMBL501046SCHEMBL23246188HMS1699F07ALBB-033188GBA60168SBB024099STK346853
Database identifiers
- CAS
31601-68-0- PubChem CID
- 303583
- DTXSID
DTXSID90307550- EC Number
- 824-808-5
- Nikkaji
- J1.198.331F
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 335 · H335-H319-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_class
- IRRITANT
- Hazard statements
- H335-H319-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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