Basic information
- Standard SMILES
O=C(O)CNc1ccc(O)cc1- InChIKey
WRUZLCLJULHLEY-UHFFFAOYSA-N- Molecular formula
- C8H9NO3
- Average molar mass
- 167.16 g/mol
- Monoisotopic mass
- 167.05824315
Overview
N-(p-hydroxyphenyl)glycine is a phenol that is the N-(4-hydroxyphenyl) derivative of glycine. Synthesised by reaction of p-aminophenol with chloracetic acid, it is used as a photographic developing agent. It has a role as an allergen. It is a glycine derivative, a member of phenols and a non-proteinogenic alpha-amino acid.
Names & identifiers
- Preferred name
- N-(4-Hydroxyphenyl)glycine
- IUPAC
- 2-(4-hydroxyanilino)acetic acid
- English name
- N-(4-Hydroxyphenyl)glycine
- Molecular formula
- C8H9NO3
- Molecular weight
- 167.16
Names & synonyms
Show more names
Database identifiers
- CAS
122-87-2- PubChem CID
- 67149
- DTXSID
DTXSID9059547- ChEBI
CHEBI:55443- UNII
- 3ET7L3AG0V
- EC Number
- 204-580-8
- Nikkaji
- J59.963H
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 69.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 152
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 244 °C · 244 °C (dec.)(lit.)
- Boiling point
- 295.73 °C · 295.73°C (rough estimate)
- Density
- 1.2917 · 1.2917 (rough estimate)
- refractive index
- 1.581 · 1.5810 (estimate)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- 1 · almost transparency in HCl1+1
- form
- Powder
- pka
- 2.17 · 2.17±0.10(Predicted)
- color
- White to beige-brown or brown-gray
- Merck
- 14 · 14,4837
- Major Application
- peptide synthesis
- InChI
- 1S/C8H9NO3/c10-7-3-1-6(2-4-7)9-5-8(11)12/h1-4,9-10H,5H2,(H,11,12)
- InChIKey
- WRUZLCLJULHLEY-UHFFFAOYSA-N
- SMILES
- OC(=O)CNc1ccc(O)cc1
- CAS DataBase Reference
- 122 · 122-87-2(CAS DataBase Reference)
- FDA UNII
- 3 ET7L3AG0V · 3ET7L3AG0V
- EPA Substance Registry System
- Glycine, N-(4-hydroxyphenyl)- (122-87-2)
- UNSPSC Code
- 12352209 · 12352209
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38-R36/37/38
- Safety Statements
- 26 · 26-36-S36-S26
- WGK Germany
- 3 · 3
- TSCA
- TSCA listed
- HS Code
- 29225000 · 29225000
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
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)
Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29225000
- risk_code
- 36/37/38-R36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36-S36-S26
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Uses
Used as a photographic developer, acid indicator in bacteriology, and reagent (determination of iron, phosphorus, and silicon); [Merck Index]
Photographic Processing [Category: Other]
Applications
UsesPhotographic developer. In determination of iron; detection and determination of phosphorus and silicon. Acid indicator in bacteriology.
Suppliers50 total
Additional notes
DefinitionChEBI: A phenol that is the N-(4-hydroxyphenyl) derivative of glycine. Synthesised by reaction of p-aminophenol with chloracetic acid, it is used as a photographic developing agent.
Related reactions
Linked notes
Loading…