Amiodarone hydrochloride

CAT: 0862-GP5750-1gSize: 1 gDry Ice: NoHazardous: Yes

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CAT#:0862-GP5750-1gSize:1 g

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CAS Number

19774-82-4

EC Number

243-293-2

UN Code

3077

MDL Number

MFCD00069204

HS Code

29329900

Purity

98.00%

Molecular Formula

C25H29I2NO3 · HCl

Molecular Weight

681.77

Storage Conditions

+4°C

Hazardous Class

True

Chemical Information

Amiodarone Hydrochloride

Amiodarone Hydrochloride can cause developmental toxicity, female reproductive toxicity and male reproductive toxicity according to state or federal government labeling requirements.

CAS Number	19774-82-4
PubChem CID	441325
IUPAC Name	(2-butyl-1-benzofuran-3-yl)-[4-[2-(diethylamino)ethoxy]-3,5-diiodophenyl]methanone;hydrochloride
Molecular Formula	C25H30ClI2NO3
Molecular Weight	681.8
Topological Polar Surface Area	42.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	11
Heavy Atom Count	32
Formal Charge	0
Complexity	547

SMILES

CCCCC1=C(C2=CC=CC=C2O1)C(=O)C3=CC(=C(C(=C3)I)OCCN(CC)CC)I.Cl

InChI

InChI=1S/C25H29I2NO3.ClH/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3;/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3;1H

InChIKey

ITPDYQOUSLNIHG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 19774-82-4

CID: 441325

Formula: C25H30ClI2NO3

MW: 681.8

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	681.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	11
Exact Mass	681.00037
Monoisotopic Mass	681.00037
Topological Polar Surface Area	42.7 Å²
Heavy Atom Count	32
Formal Charge	0
Complexity	547
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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Amiodarone hydrochloride

Chemical Information

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