Basic information
- Standard SMILES
CCCNCC(O)COc1ccc(O)cc1C(=O)CCc1ccccc1.Cl- InChIKey
FAYLNKVZLXBDBE-UHFFFAOYSA-N- Molecular formula
- C21H28ClNO4
- Average molar mass
- 393.9 g/mol
Names & identifiers
- Preferred name
- 5-Hydroxy Propafenone Hydrochloride
- IUPAC
- 1-[5-hydroxy-2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one;hydrochloride
- English name
- 5-Hydroxy Propafenone-D5 Hydrochloride
- Molecular formula
- C21H28ClNO4
- Molecular weight
- 393.90432
Names & synonyms
5-Hydroxy Propafenone Hydrochloride86383-32-65-Hydroxypropafenone Hydrochloride5-Hydroxy propafenone HCl1-(5-hydroxy-2-(2-hydroxy-3-(propylamino)propoxy)phenyl)-3-phenylpropan-1-one hydrochloridePropafenone Impurity 10orb3027420orb3141217MFCD08063695AKOS0302553361-[5-hydroxy-2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one;hydrochlorideT207763
Show more names
GPV 129-d5Propafenone Impurity 445-Hydroxy Propafenone D5GPV-129 D5 HydrochlorideImazamox Impurity 19 (Imazethapyr)5-Hydroxy Propafenone-D5 Hydrochloride[2H5]-5-Hydroxy Propafenone Hydrochloride5-Hydroxy Propafenone (Propoxy-D5) Hydrochloride-d51-[5-Hydroxy-2-[2-hydroxy-3-(propylamino)propoxy]phenl]-3-phenyl-1-propanone- d5 Hydrochloride
1-[5-hydroxy-2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenyl-propan-1-one;hydrochloride
Database identifiers
- CAS
1215370-87-8- EC Number
- 642-040-7
Properties
Computed structural properties
- Topological polar surface area
- 78.8 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 11
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 397
Physicochemical properties
- Melting point
- 214 · 214-216°C
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- DMSO, Methanol
- form
- Solid
- color
- Off-White To Pale Yellow
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, 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.
Chemistry & industry
Applications
UsesA labelled metabolite of Propafenone (P757500).
Suppliers13 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
玺标（上海）科技有限公司18512111473 18512111473 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
Musechem+1-800-259-7612 · [email protected]
上海语锌医药科技有限公司15921286451; 15921286451 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]
Related reactions
0 records
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Linked notes
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