4-Hydroxy Propafenone Hydrochloride

CAT: 0024-sc-210056Size: 2.5 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0024-sc-210056Size:2.5 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

86383-31-5

Chemical Information

4-Hydroxy Propafenone Hydrochloride

CAS Number	86383-31-5
PubChem CID	45039497
IUPAC Name	1-[4-hydroxy-2-[2-hydroxy-3-(propylamino)propoxy]phenyl]-3-phenylpropan-1-one;hydrochloride
Molecular Formula	C21H28ClNO4
Molecular Weight	393.9
Topological Polar Surface Area	78.8
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Heavy Atom Count	27
Formal Charge	0
Complexity	397

SMILES

CCCNCC(COC1=C(C=CC(=C1)O)C(=O)CCC2=CC=CC=C2)O.Cl

InChI

InChI=1S/C21H27NO4.ClH/c1-2-12-22-14-18(24)15-26-21-13-17(23)9-10-19(21)20(25)11-8-16-6-4-3-5-7-16;/h3-7,9-10,13,18,22-24H,2,8,11-12,14-15H2,1H3;1H

InChIKey

WKRSKHMUIJZGKZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 86383-31-5

CID: 45039497

Formula: C21H28ClNO4

MW: 393.9

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	393.9
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	11
Exact Mass	393.1706861
Monoisotopic Mass	393.1706861
Topological Polar Surface Area	78.8 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	397
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
sc-216863	4-Hydroxy Propafenone-d5 Hydrochloride
sc-210333	5-Hydroxy Propafenone Hydrochloride
sc-212873	(S) -5-Hydroxy Propafenone Hydrochloride
sc-217198	5-Hydroxy Propafenone-d5 Hydrochloride
sc-488190	5-Hydroxy Propafenone Hydrochloride-d5
sc-212677	(R) -5-Hydroxy Propafenone Hydrochloride
sc-204863B	Propafenone Hydrochloride
sc-204863C	Propafenone Hydrochloride
sc-204863	Propafenone Hydrochloride
sc-204863A	Propafenone Hydrochloride

Catalog	Name
279193-01	4-Hydroxy propafenone hydrochloride
TRC-H952447-1MG	4-Hydroxy Propafenone-d5 Hydrochloride
HY-132484S-01	4-Hydroxy Propafenone-d5 (hydrochloride)
TRC-H952450-10MG	5-Hydroxy Propafenone Hydrochloride
HY-12773A-01	5-Hydroxy Propafenone (hydrochloride)
HY-12773AS2	5-Hydroxy Propafenone-d6 (hydrochloride)
TRC-H952455-25MG	(R)-5-Hydroxy Propafenone Hydrochloride
436673-01	5-Hydroxy Propafenone Hydrochloride-d5
TRC-H952452-10MG	5-Hydroxy Propafenone-d5 Hydrochloride
HY-12773AS-01	5-Hydroxy Propafenone-d5 (hydrochloride)