Neostigmine Bromide Impurity 16

CAT: 1299-RM-N051516-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-N051516-01Size:10 mg

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CAS Number

76418-45-6

Synonyms

3- (methylamino) phenyl dimethylcarbamate

Molecular Formula

C10H14N2O2

Molecular Weight

194.23

Target Alternative Name

Neostigmine

Product Name Synonym

3- (methylamino) phenyl dimethylcarbamate

Chemical Information

3-(Methylamino)phenyl dimethylcarbamate

CAS Number	76418-45-6
PubChem CID	13443409
IUPAC Name	[3-(methylamino)phenyl] N,N-dimethylcarbamate
Molecular Formula	C10H14N2O2
Molecular Weight	194.23
XLogP	1.6
Topological Polar Surface Area	41.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	14
Formal Charge	0
Complexity	195

SMILES

CNC1=CC(=CC=C1)OC(=O)N(C)C

InChI

InChI=1S/C10H14N2O2/c1-11-8-5-4-6-9(7-8)14-10(13)12(2)3/h4-7,11H,1-3H3

InChIKey

RELMCRVAQDIBIU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 76418-45-6

CID: 13443409

Formula: C10H14N2O2

MW: 194.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	194.23
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	194.105527694
Monoisotopic Mass	194.105527694
Topological Polar Surface Area	41.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	195
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	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-N051506-01	Neostigmine Bromide Impurity 6
RM-N051511-01	Neostigmine Bromide Impurity 11
RM-N051507-01	Neostigmine Bromide Impurity 7
RM-N051504-01	Neostigmine Bromide Impurity 4
RM-N051514-01	Neostigmine Bromide Impurity 14
RM-N051518-01	Neostigmine Bromide Impurity 18
RM-N051517-01	Neostigmine Bromide Impurity 17
RM-N051515-01	Neostigmine Bromide Impurity 15
RM-N051505-01	Neostigmine Bromide Impurity 5
RM-N051513-01	Neostigmine Bromide Impurity 13

Catalog	Name
TMIJ-0504-01	Neostigmine Bromide EP Impurity C-d6
B1594-500	Neostigmine Bromide
HY-B0423-01	Neostigmine (Bromide)
HY-B0423R-01	Neostigmine (Bromide) (Standard)
MBS385998-01	Neostigmine bromide (Prostigmin)
A10635-1000	Neostigmine bromide (Prostigmin) 1000mg
A10635-500	Neostigmine bromide (Prostigmin) 500mg
A10635-100	Neostigmine bromide (Prostigmin) 100mg
A10635-250	Neostigmine bromide (Prostigmin) 250mg
285119-01	Neostigmine bromide discontinued. See N1062