2-Amino-2-phenylpropanoic acid
Basic information
- CAS
565-07-1- Standard SMILES
CC(N)(C(=O)O)c1ccccc1- InChIKey
HTCSFFGLRQDZDE-UHFFFAOYSA-N- Molecular formula
- C9H11NO2
- Average molar mass
- 165.19 g/mol
- Monoisotopic mass
- 165.07897859
Names & identifiers
- Preferred name
- 2-Amino-2-phenylpropanoic acid
- IUPAC
- 2-amino-2-phenylpropanoic acid
- English name
- 2-amino-2-phenyl-propanoic acid
- Molecular formula
- C9H11NO2
- Molecular weight
- 0
Names & synonyms
2-amino-2-phenylpropanoic acid565-07-12-Phenylalanine2-Aminohydratropic acidDL-.alpha.-PhenylalanineDL-alpha-PhenylalanineRefChem:85088622-722-0HTCSFFGLRQDZDE-UHFFFAOYSA-N6945-32-02-Amino-2-phenylpropionic acid2-AMINO-2-PHENYL-PROPANOIC ACID
Show more names
Nsc16591
2-amino-2-phenyl-propionic acidMFCD00195631benzeneacetic acid, alpha-amino-alpha-methyl-DL-2-Phenylalanine2-Amino-2-phenylpropanoicacidPhenyl-a-aminopropionsaureSCHEMBL59841CHEMBL203931
Database identifiers
- CAS
565-07-1、6945-32-0- PubChem CID
- 31722
- DTXSID
DTXSID10902586- EC Number
- 622-722-0
- Nikkaji
- J347.980C
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 175
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 Classification
Warning
H302 (97.5%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (97.5%)
Related reactions
8 records
Compound notes
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