Methyl phenidate impurity E

CAT: 0926-ZDA08855-01Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0926-ZDA08855-01Size:25 mg

Selected

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

Quick Request Actions

CAS Number

99088-55-8

Smiles

CCOC (=O) C (C1CCCCN1) C2=CC=CC=C2

Molecular Formula

C15H21NO2

Molecular Weight

247.33 g/mol

Controlled

Yes

Chemical Information

(RS)-Ethyl 2-phenyl-2-piperidin-2-ylacetate

EPH is an aralkylamine.

CAS Number	99088-55-8
PubChem CID	11391957
IUPAC Name	ethyl (2R)-2-phenyl-2-[(2R)-piperidin-2-yl]acetate
Molecular Formula	C15H21NO2
Molecular Weight	247.33
XLogP	0.6
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	18
Formal Charge	0
Complexity	261

SMILES

CCOC(=O)[C@@H]([C@H]1CCCCN1)C2=CC=CC=C2

InChI

InChI=1S/C15H21NO2/c1-2-18-15(17)14(12-8-4-3-5-9-12)13-10-6-7-11-16-13/h3-5,8-9,13-14,16H,2,6-7,10-11H2,1H3/t13-,14-/m1/s1

InChIKey

AIVSIRYZIBXTMM-ZIAGYGMSSA-N

Chemical Structure

2D Structure

CAS: 99088-55-8

CID: 11391957

Formula: C15H21NO2

MW: 247.33

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	247.33
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	247.157228913
Monoisotopic Mass	247.157228913
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	261
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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
VAA74812-01	Methyl phenidate impurity C
IM25526-01	Methyl mycophenolate impurity E
KAA48570-01	(E, E) Methyl farnesoate
IO159550-01	Oxaliplatin Impurity E
IN167083-01	Naltrexone impurity E
IC76330-01	Chlorthalidone impurity E
FA175652-01	Acarbose Impurity E
IB106310-01	Linagliptin impurity E
IR106453	Roxithromycin impurity E
IIA76235-01	Abacavir Impurity E

Catalog	Name
TRC-M385949-5MG	Methyl phenidate D10
464465	Rac-threo-Methyl-13C, d3-phenidate Hydrochloride
TRC-M325679-1MG	rac-erythro Methyl-13C, d3-phenidate Hydrochloride
TRC-N201800-25MG	Nintedanib Methyl Impurity
CS-O-60229	Varespladib Methyl Impurity
RM-S120301-01	Methyl Salicylate Impurity A
AR-F01456-01	Fingolimod Methyl Impurity
AR-P31995-01	Plerixafor Methyl Impurity
AR-A02252-01	Apixaban Methyl Impurity
AR-F01242-01	Felbamate Methyl Impurity