3-Amino-2-phenylpropanoic acid hydrochloride
Basic information
- CAS
90765-41-6- Standard SMILES
Cl.NCC(C(=O)O)c1ccccc1- InChIKey
XXQQHYDQYMUUMP-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO2
- Average molar mass
- 201.65 g/mol
- Monoisotopic mass
- 201.0556563
Names & identifiers
- Preferred name
- 3-Amino-2-phenylpropanoic acid hydrochloride
- IUPAC
- 3-amino-2-phenylpropanoic acid;hydrochloride
- English name
- 3-Amino-2-phenylpropanoic acid hydrochloride
- Molecular formula
- C9H12ClNO2
- Molecular weight
- 201.65008
Names & synonyms
3-amino-2-phenylpropanoic acid hydrochloride90765-41-6RefChem:497071838-687-1MFCD016743923-Amino-2-phenylpropionic acid hydrochloride3-amino-2-phenylpropanoic acid;hydrochlorideSCHEMBL7609245NIOSH/AY75630002-Phenyl-beta-alanine hydrochloride3-Amino-2-phenyl-propionic acid HClAKOS015996830
Show more names
rac 3-Amino-2-phenyl-propionic ac
beta-Alanine, 2-phenyl-, hydrochloride3-amino-2-phenylpropanoicacidhydrochloriderac 3-Amino-2-phenyl-propionic acid x HClAY75630000CS-02379773-amino-2-phenyl-propanoic acid;hydrochlorideA50497EN300-188654
Database identifiers
- CAS
90765-41-6- PubChem CID
- 12697489
- EC Number
- 838-687-1
Properties
Computed structural properties
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Melting point
- 220 · 220-221 °C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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