Basic information
- CAS
134052-66-7- Standard SMILES
NC(C(=O)O)c1ccc(C(=O)O)c(O)c1- InChIKey
GXZSAQLJWLCLOX-UHFFFAOYSA-N- Molecular formula
- C9H9NO5
- Average molar mass
- 211.17 g/mol
- Monoisotopic mass
- 211.04807239
Overview
4-[amino(carboxy)methyl]-2-hydroxybenzoic acid is a hydroxybenzoic acid. It is functionally related to a salicylic acid.
Names & identifiers
- Preferred name
- 4-Carboxy-3-hydroxyphenylglycine
- IUPAC
- 4-[amino(carboxy)methyl]-2-hydroxybenzoic acid
- English name
- (RS)-4-Carboxy-3-hydroxyphenylglycine
- Molecular formula
- C9H9NO5
- Molecular weight
- 211.17
Names & synonyms
134052-66-74-Chpgly4-Carboxy-3-hydroxyphenylglycineM725GQ103ABenzeneacetic acid, alpha-amino-4-carboxy-3-hydroxy-RefChem:912411(RS)-4-Carboxy-3-hydroxyphenylglycine4-[amino(carboxy)methyl]-2-hydroxybenzoic acid(RS)-4C3HPGUNII-M725GQ103Aalpha-Amino-4-carboxy-3-hydroxybenzeneacetic acidBenzeneacetic acid, a-amino-4-carboxy-3-hydroxy-
Show more names
(RS)-4C3H-PG4-Carboxy-3-hydroxyphenylglycine (RS)-CARBOXYHYDROXYPHENYLGLYCINE, (RS)-, 4, 3,4-[amino(carboxy)methyl]-2-hydroxybenzoicaci(RS)-4-CARBOXY-3-HYDROXYPHENYLGLYCINE USP/EP/BPBenzeneacetic acid, α-amino-4-carboxy-3-hydroxy-4-(1-amino-2-hydroxy-2-oxoethyl)-2-hydroxybenzoic acid
(+-)-alpha-Amino-4-carboxy-3-hydroxybenzeneacetic acidCHEMBL4445894-(Amino(carboxy)methyl)-2-hydroxybenzoic acidBenzeneacetic acid, alpha-amino-4-carboxy-3-hydroxy-, (+-)-orb1704139SCHEMBL12648353CHEBI:93904DTXSID60928397
Database identifiers
- CAS
134052-66-7- PubChem CID
- 1297
- DTXSID
DTXSID60928397- ChEMBL
CHEMBL444589- ChEBI
CHEBI:93904- UNII
- M725GQ103A
- Nikkaji
- J1.170.046B
Properties
Computed structural properties
- XLogP
- -1
- Topological polar surface area
- 121 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Boiling point
- 479.1 · 479.1±45.0 °C(Predicted)
- Density
- 1.596 · 1.596±0.06 g/cm3(Predicted)
- storage temp.
- Store at RT
- solubility
- 100 mM · Soluble to 100 mM in 1eq. NaOH
- form
- Powder
- pka
- 1.62 · 1.62±0.10(Predicted)
- FDA UNII
- 725 GQ103A · M725GQ103A
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Drugs intended to prevent damage to the brain or spinal cord from ischemia, stroke, convulsions, or trauma. Some must be administered before the event, but others may be effective for some time after. They act by a variety of mechanisms, but often directly or indirectly minimize the damage produced by endogenous excitatory amino acids.
Applications
Uses(RS)-4C3H-PG is a broad spectrum EAA ligand.
Suppliers11 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
Nextpeptide Inc+86-0571-81612335 +8613336028439 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]
Additional notes
DefinitionChEBI: 4-[amino(carboxy)methyl]-2-hydroxybenzoic acid is a hydroxybenzoic acid. It is functionally related to a salicylic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…