Amino(phenyl)acetic Acid
fo-796ddaeb868da2c3
Identity
- Type
- Neutral molecule
- CAS
- 875-74-1
- EC
- 212-876-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 57 across every transformer
Structure
This substance carries 2 candidate structures; the diagram is the first one RDKit could parse, not a settled answer.
Alternative labels
28- (-)-(R)-Phenylglycine
- (-)-Phenylglycine
- (2R)-2-Amino-2-phenylacetic acid
- (2R)-2-Azaniumyl-2-phenylacetate
- (2R)-amino(phenyl)acetic acid
- (2R)-Amino-2-phenylethanoic acid
- (R)-(-)-2-Phenylglycine
- (R)-2-Amino-2-phenylacetic acid
- (R)-2-Amino-2-phenylethanoic acid
- (R)-2-Phenyl-2-aminoethanoic acid
- (R)-2-Phenylglycine
- (R)-phenylglycine
- (R)-α-Phenylglycine
- (αR)-α-Aminobenzeneacetic acid
- Benzeneacetic acid, α-amino-, (R)-
- Benzeneacetic acid, α-amino-, (αR)-
- D-(-)-2-Phenylglycine
- D-(-)-alpha-Phenylglycine
- D-(-)-Aminophenylacetic acid
- D-(-)-Phenylglycine
- D-(-)-α-Aminophenylacetic acid
- D-(-)-α-Phenylglycine
- D-2-Phenylglycine
- D-C-Phenylglycine
- D-PHENYLGLYCINE
- D-α-Aminophenylacetic acid
- D-α-Phenylglycine
- Glycine, 2-phenyl-, D-
Properties
| Property | Value |
|---|---|
| Elemental charge chemrof:elemental_charge | 0 |
| InChI2D key string chemrof:inchi2d_key_string | ZGUNAGUHMKGQNY-SSDOTTSWSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C8H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H,10,11)/t7-/m1/s1 |
| Isomeric SMILES string chemrof:isomeric_smiles_string | N[C@@H](C(=O)O)c1ccccc1 |
| IUPAC name chemrof:IUPAC_name | (2R)-amino(phenyl)acetic acid |
| Molecular formula chemrof:molecular_formula | C8H9NO2 |
| Molecular mass chemrof:molecular_mass | 151.165 |
| Monoisotopic mass chemrof:monoisotopic_mass | 151.063329, 151.06333 |
| SMILES string chemrof:smiles_string | NC(C(=O)O)c1ccccc1 |
Known URLs
15Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| beilstein | beilstein:2208676 | enrich_references.chebi_xrefs |
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=875-74-1 | enrich_references.chebi_xrefs |
| ChEBI | https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:44962 | enrich_references.chebi_id_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.011.706 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID50889362 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL1403 | enrich_references.pubchem_identifier_url |
| gmelin | gmelin:364514 | enrich_references.chebi_xrefs |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/GF5LYS471N | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.151J | enrich_references.pubchem_identifier_url |
| metabolomicsworkbench.org | https://www.metabolomicsworkbench.org/data/StructureData.php?RegNo=52402 | enrich_references.pubchem_identifier_url |
| pdb-ccd | pdb-ccd:PG9 | enrich_references.chebi_xrefs |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/70134 | enrich_references.pubchem_compound |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/20815935 | enrich_references.chebi_xrefs |
| PubMed | https://pubmed.ncbi.nlm.nih.gov/7716788 | enrich_references.chebi_xrefs |
| wikidata.org | https://www.wikidata.org/wiki/Q423849 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ebdead29-8ae0-4f72-8c62-f5479b6e4da2 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 2ab43592-e103-40c9-b02d-ed0b7572b04f | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| c422fcc1-8bc9-4350-929b-11304bd7c251 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| a829d3aa-81ea-4c3c-a6b5-86817b2254fe | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| db0b3311-0b4c-4df6-96dc-e9e436a93e79 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| e2fb09f7-e3fd-467f-b19c-da4beda3ca57 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 5233f057-50bb-4c1c-8fc6-4d7b67628a06 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| f74a05ac-f2f4-4a0c-b729-53470b0cfba2 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| a69fba3c-a91a-4045-9c03-aee0958029a7 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 27fdba29-ee3e-4b9a-ae25-403a508074ea | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 876c5b02-0118-4d71-af23-bf5809205d5a | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 1bce28c8-9573-421b-9540-9900fda1cb72 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 2cdc8b0e-ca8b-4712-aa68-bf8a4d33d1d9 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (57 changes)
Full record
Flow object JSON
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