Rivastigmine impurity 1

CAT: 0572-TRC-R247080-25MGSize: 25 mgDry Ice: NoHazardous: No

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CAT#:0572-TRC-R247080-25MGSize:25 mg

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CAS Number

1369779-38-3

Hazard Statement

No Data Available

Smiles

CN([C@H](C1=CC(O)=CC=C1)C)(C)=O

Molecular Formula

C10 H15 N O2

Molecular Weight

181.23

Chemical Information

Rivastigmine impurity 1

CAS Number	1369779-38-3
PubChem CID	73357706
IUPAC Name	(1S)-1-(3-hydroxyphenyl)-N,N-dimethylethanamine oxide
Molecular Formula	C10H15NO2
Molecular Weight	181.23
XLogP	1.2
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	170

SMILES

C[C@@H](C1=CC(=CC=C1)O)[N+](C)(C)[O-]

InChI

InChI=1S/C10H15NO2/c1-8(11(2,3)13)9-5-4-6-10(12)7-9/h4-8,12H,1-3H3/t8-/m0/s1

InChIKey

IKJXNUVVPHBWRX-QMMMGPOBSA-N

Chemical Structure

2D Structure

CAS: 1369779-38-3

CID: 73357706

Formula: C10H15NO2

MW: 181.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.23
XLogP3	1.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	181.110278721
Monoisotopic Mass	181.110278721
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	170
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-R220904-01	Rivastigmine USP Impurity D; Rivastigmine EP Impurity C
RM-R221954-01	Rivastigmine Impurity 27
RM-R221966-01	Rivastigmine Impurity 37
RM-R221903-01	Rivastigmine EP Impurity A
RM-R221953-01	Rivastigmine Impurity 26
RM-R221963-01	Rivastigmine Impurity 34
RM-R221940-01	Rivastigmine Impurity 14
RM-R221933-01	Rivastigmine Impurity 5
RM-R221934-01	Rivastigmine Impurity 6
RM-R221965-01	Rivastigmine Impurity 36