2-[[4-(2-methylpropoxy)benzoyl]amino]acetic Acid
Basic information
- CAS
51220-56-5- Standard SMILES
CC(C)COc1ccc(C(=O)NCC(=O)O)cc1- InChIKey
XRYHKZYGGVOLQY-UHFFFAOYSA-N- Molecular formula
- C13H17NO4
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.11575802
Names & identifiers
- Preferred name
- 2-[[4-(2-methylpropoxy)benzoyl]amino]acetic Acid
- IUPAC
- 2-[[4-(2-methylpropoxy)benzoyl]amino]acetic acid
Names & synonyms
51220-56-52-[[4-(2-methylpropoxy)benzoyl]amino]acetic Acid(4-Isobutoxybenzoyl)glycine2-(4-Isobutoxybenzamido)acetic acidGlycine, N-[4-(2-methylpropoxy)benzoyl]-Oprea1_694966SCHEMBL834768DTXSID50358684AKOS008984406N-[4-(2-Methylpropoxy)benzoyl]glycine2-[(4-isobutoxybenzoyl)amino]acetic acidCS-0362978
Show more names
A1-05724
Database identifiers
- CAS
51220-56-5- PubChem CID
- 910124
- DTXSID
DTXSID50358684
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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