Hippuric acid, monosodium salt
Basic information
- CAS
532-94-5- Standard SMILES
O=C([O-])CNC(=O)c1ccccc1.[Na+]- InChIKey
ZBCAZEFVTIBZJS-UHFFFAOYSA-M- Molecular formula
- C9H8NNaO3
- Average molar mass
- 201.15 g/mol
- Monoisotopic mass
- 201.0401874
Names & identifiers
- Preferred name
- Hippuric acid, monosodium salt
- IUPAC
- sodium 2-benzamidoacetate
- English name
- Hippuric acid sodium salt
- Molecular formula
- C9H10NNaO3
- Molecular weight
- 203.17
Names & synonyms
HIPPURIC ACID, MONOSODIUM SALTRefChem:788379Sodium hippurate532-94-5Hippuric acid sodium saltsodium 2-benzamidoacetateN-Benzoylglycine sodium saltGlycine, N-benzoyl-, monosodium saltsodium;2-benzamidoacetateHippurate sodiumCCRIS 5812EINECS 208-548-4
Show more names
CYCLO-PRO-HIS-OHSodiumHippurate98%SodiumHippurate>Sodiumhippurate,96%Hippuric acid sodiumSodium Hippurate 98%Sodium hippurate hydrate
Benzoylaminoacetic acid sodium saltSodium hippurate, 98%AKOS015888375AKOS015951071D78474Glycine, N-benzoyl-, sodium salt (1:1)Sodium 2-benzamidoacetate hydrateMFCD00002693
Database identifiers
- CAS
532-94-5- PubChem CID
- 516953
- DTXSID
DTXSID0060199- ChEMBL
CHEMBL135276- EC Number
- 208-548-4
- Nikkaji
- J24.962I
Properties
Computed structural properties
- Topological polar surface area
- 69.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 202
Physicochemical properties
- Melting point
- 240 · 240~244℃
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- 2 O: · H2O: 0.5 M at 20 °C, clear, colorless
- form
- Solid
- color
- White powder
- Water Solubility
- Soluble in water.
- BRN
- 3638470 · 3638470
- Major Application
- detection
- InChI
- 1S/C9H9NO3.Na.H2O/c11-8(12)6-10-9(13)7-4-2-1-3-5-7;;/h1-5H,6H2,(H,10,13)(H,11,12);;1H2/q;+1;/p-1
- InChIKey
- IOZRWVOSUXHESF-UHFFFAOYSA-M
- SMILES
- O.[Na+].[O-]C(=O)CNC(=O)c1ccccc1
- CAS DataBase Reference
- 532 · 532-94-5(CAS DataBase Reference)
- EPA Substance Registry System
- Glycine, N-benzoyl-, monosodium salt (532-94-5)
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 26 · NA.26
- Symbol(GHS)
- 6 · GHS06
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 ClassificationNot Classified
Hazard information
Regulatory Information
Chemical: Glycine, N-benzoyl-, monosodium salt
Glycine, N-benzoyl-, monosodium salt: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesNot Classified
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- MR8170000
- hs_code
- 2924.29.9500
- risk_code
- 22-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- Xn
- safety_code
- 24/25-36/37-26-22
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H301-H315-H319-H335
- Precautionary statements
- P261-P301+P310-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationGlycine, N-benzoyl-, sodium salt (1:1): ACTIVE
Applications
UsesHippuric Acid Sodium Salt can be used for agrobacterium-mediated rice genetic transformation method.
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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