DL-Phenylalaninol
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Basic information
- CAS
16088-07-6- Standard SMILES
NC(CO)Cc1ccccc1- InChIKey
STVVMTBJNDTZBF-UHFFFAOYSA-N- Molecular formula
- C9H13NO
- Average molar mass
- 151.21 g/mol
- Monoisotopic mass
- 151.09971404
Names & identifiers
- Preferred name
- DL-Phenylalaninol
- IUPAC
- 2-amino-3-phenylpropan-1-ol
- English name
- DL-Phenylalaninol
- Molecular formula
- C9H13NO
- Molecular weight
- 151.21
Names & synonyms
DL-PhenylalaninolBenzenepropanol, beta-amino-C8L8LX87R1NSC-20899PHENYLALANINOL, DL-BENZENEPROPANOL, .BETA.-AMINO-RefChem:200704PHENYLALANINOL, (+-)-(+-)-2-AMINO-3-PHENYL-1-PROPANOL605-234-22-amino-3-phenylpropan-1-ol16088-07-6
Show more names
PHENYLALANINOLAKOS 91608AKOS BB-8726DL-Phenylalaninol>DL-Phenylalaninol, GC 98%Benzenepropanol, b-aMino-Benzenepropanol, β-amino-DL-Phenylalaninol:DL-Phe-OL
2-Amino-3-phenyl-1-propanolMFCD000666892-Amino-3-Phenyl-Propan-1-OlD(+)-Phenylalaninol2-amino-3-phenylpropanolCHEMBL21676DL-2-Amino-3-phenyl-1-propanolD(+)-2-Amino-3-phenyl-1-propanol
Database identifiers
- CAS
16088-07-6- PubChem CID
- 76652
- DTXSID
DTXSID90863121- ChEMBL
CHEMBL21676- UNII
- C8L8LX87R1
- EC Number
- 605-234-2
- Nikkaji
- J304.028C
Properties
Computed structural propertiesFilling in
- XLogP
- 0.7
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 99.7
Physicochemical properties
- Melting point
- 64 · 64-72 °C
- Boiling point
- 130 °C/3mmHg · 130°C/3mmHg(lit.)
- Density
- 1.077 · 1.077±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
- pka
- 12.85 · 12.85±0.10(Predicted)
- form
- Crystalline Powder and Chunks
- color
- White to light yellow
- CAS DataBase Reference
- 16088 · 16088-07-6
- FDA UNII
- 8 L8LX87R1 · C8L8LX87R1
- Symbol(GHS)
- 5 · GHS05
- Signal word
- Danger
- Hazard statements
- 314 · H314-H318
- Precautionary statements
- 260 h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P501a-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501 · P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P501a-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-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
Danger
H314 (95%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (95%)
Safety data
- ridadr
- 3259
- hs_code
- 2922199090
- risk_code
- 34
- Signal word
- Danger
- Symbol(GHS)
- GHS05
- hazard_code
- C
- safety_code
- 45-36/37/39-26
- hazard_class
- 8
- packing_group
- Ⅲ
- Hazard statements
- H314-H318
- Precautionary statements
- P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P501a-P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Chemistry & industry
Applications
UsesDL-Phenylalaninol may inhibit ulcer formation in rats, mainly by central inhibition of gastric acid secretion.
Upstream & downstream products
Upstream raw materials
Related reactions
44 records
Compound notes
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