[4-(4-Fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid
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Basic information
- CAS
956327-03-0- Standard SMILES
CC1(c2ccc(F)cc2)NC(=O)N(CC(=O)O)C1=O- InChIKey
BYNVPEAJZWNGHA-UHFFFAOYSA-N- Molecular formula
- C12H11FN2O4
- Average molar mass
- 266.22 g/mol
- Monoisotopic mass
- 266.070285
Names & identifiers
- Preferred name
- [4-(4-Fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid
- IUPAC
- 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid
- English name
- METHYL 2-[(CHLOROACETYL)AMINO]-4-METHYLPENTANOATE
- Molecular formula
- C12H11FN2O4
- Molecular weight
- 266.23
Names & synonyms
956327-03-0[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetic acid2-(4-(4-Fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl)acetic acid4-(4-Fluorophenyl)-4-methyl-2,5-dioxo-1-imidazolidineacetic acid4-(4-Fluorophenyl)-4-methyl-2,5-dioxoimidazolidine-1-acetic AcidMFCD08729200AKOS009079768SY171320EN300-23565G27288F913209
Show more names
METHYL 2-[(CHLOROACETYL)AMINO]-4-METHYLPENTANOATE1-Imidazolidineacetic acid, 4-(4-fluorophenyl)-4-methyl-2,5-dioxo-
Z1546662062-(4-(4-Fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl)aceticacid2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxo-imidazolidin-1-yl]acetic acid
Database identifiers
- CAS
956327-03-0- PubChem CID
- 16227028
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- Density
- 1.417 · 1.417±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 3.75 · 3.75±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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