Basic information
- CAS
5053-63-4- Standard SMILES
NCCC(O)c1ccccc1- InChIKey
PHIYHIOQVWTXII-UHFFFAOYSA-N- Molecular formula
- C9H13NO
- Average molar mass
- 151.21 g/mol
- Monoisotopic mass
- 151.09971404
Names & identifiers
- Preferred name
- 3-Amino-1-phenylpropan-1-ol
- IUPAC
- 3-amino-1-phenylpropan-1-ol
- English name
- 3-Amino-1-phenyl-propan-1-ol
- Molecular formula
- C9H13NO
- Molecular weight
- 151.21
Names & synonyms
3-amino-1-phenylpropan-1-ol5053-63-4DTXSID80964752alpha-(2-aminoethyl)benzenemethanolRefChem:496853DTXCID20973787822-925-63-AMINO-1-PHENYL-PROPAN-1-OL3-amino-1-phenyl-1-propanol3-Amino-1-phenyl-propanol3-Phenyl-3-hydroxypropylamineMFCD00039784
Show more names
-PROPAN-1-OL3-AMINO-1-PHENYLFluoxetine Impurity 233-amino-1-phenylpropane-1-ol
3-Hydroxy-3-phenylpropylamineFluoxetine Impurity 11a-(2-Aminoethyl)benzenemethanol1-Phenyl-1-hydroxy-3-aminopropaneSCHEMBL42066AKOS BB-9499SCHEMBL5164372RARECHEM AL BW 2289
Database identifiers
- CAS
5053-63-4- PubChem CID
- 121548
- DTXSID
DTXSID80964752- EC Number
- 822-925-6
- Nikkaji
- J874.641I
Properties
Computed structural properties
- XLogP
- 0.5
- 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
- 50 · 50-53°C
- Boiling point
- 126 · 126-130 °C(Press: 1.5 Torr)
- Density
- 1.074 · 1.074±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 14.13 · 14.13±0.20(Predicted)
- color
- Off-White to Pale Yellow
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H332-H335
- Precautionary statements
- 280 · P280-P305+P351+P338-P310
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-41
- Safety Statements
- 26 · 26-39
- HS Code
- 2922390090 · 2922390090
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
- hs_code
- 2922390090
- risk_code
- 22-41
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-39
- Hazard statements
- H302-H315-H319-H332-H335
- Precautionary statements
- P280-P305+P351+P338-P310
Chemistry & industry
Applications
Uses3-Phenyl-3-hydroxypropylamine (cas# 5053-63-4) is a compound useful in organic synthesis.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers59 total
上海康恩博医药科技有限公司17510465506 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海爱孜康医药研究有限公司18721109360 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.
Related reactions
22 records
Compound notes
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