Meldonium EP Impurity E

CAT: 1299-RM-M650013-04Size: 50 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-M650013-04Size:50 mg

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CAS Number

1093122-25-8

Synonyms

2- (3-isopropoxy-3-oxopropyl) -1,1,1-trimethylhydrazin-1-ium bromide

Molecular Formula

C9H21N2O2 Br

Molecular Weight

189.28 79.90

Target Alternative Name

Meldonium

Chemical Information

2-(3-Isopropoxy-3-oxopropyl)-1,1,1-trimethylhydrazin-1-ium bromide

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CAS Number	1093122-25-8
PubChem CID	118849793
IUPAC Name	trimethyl-[(3-oxo-3-propan-2-yloxypropyl)amino]azanium bromide
Molecular Formula	C9H21BrN2O2
Molecular Weight	269.18
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Heavy Atom Count	14
Formal Charge	0
Complexity	161

SMILES

CC(C)OC(=O)CCN[N+](C)(C)C.[Br-]

InChI

InChI=1S/C9H21N2O2.BrH/c1-8(2)13-9(12)6-7-10-11(3,4)5;/h8,10H,6-7H2,1-5H3;1H/q+1;/p-1

InChIKey

YNNVCOARVPJOMI-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 1093122-25-8

CID: 118849793

Formula: C9H21BrN2O2

MW: 269.18

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	269.18
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	6
Exact Mass	268.07864
Monoisotopic Mass	268.07864
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	161
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

Catalog	Name
RM-M551001-01	Meldonium EP Impurity D
RM-M650012-01	Meldonium EP Impurity D
RM-L202405-01	Levothyroxine EP Impurity E; Liothyronine EP Impurity E
RM-O132305-01	Omeprazole EP Impurity E; Esomeprazole EP Impurity E
RM-P182605-01	Prazosin EP Impurity E; Doxazosin EP Impurity H; Terazosin EP Impurity E
RM-T162005-01	Tryptophan EP Impurity E; N-Acetyltryptophan EP Impurity E
RM-L052705-01	Levomethadone hydrochloride EP Impurity E; Methadone EP Impurity E
RM-F121105-01	Fluconazole EP Impurity E; Voriconazole EP Impurity A
RM-L130605-01	Lamivudine EP Impurity E; Gemcitabine EP Impurity A
RM-A020405-01	Albendazole EP Impurity E; Fenbendazole EP Impurity A

Catalog	Name
HY-B1836-01	Meldonium
sc-483554	Meldonium dihydrate
A12316-100	Meldonium 100mg
HY-B1836S	Meldonium-d3
HY-B1836A-01	Meldonium (dihydrate)
HY-B1836R-01	Meldonium (Standard)
A12316-50	Meldonium 50mg
HY-B1836AR-01	Meldonium (dihydrate) (Standard)
BT164669	Meldonium dihydrate - Bio-X TM
AR-C02408-01	Chlorguanide Impurity A (Proguanil Impurity A)