Fentanyl Nitroso Impurity 16

CAT: 1299-RM-F201416-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-F201416-01Size:10 mg

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CAS Number

1184873-14-0

Synonyms

N- (1-phenethylpiperidin-4-yl) -N-phenylnitrous amide

Molecular Formula

C19H23N3O

Molecular Weight

309.41

Target Alternative Name

Fentanyl

Chemical Information

N-Nitroso Fentanyl EP Impurity D

CAS Number	1184873-14-0
PubChem CID	176478564
IUPAC Name	N-phenyl-N-[1-(2-phenylethyl)piperidin-4-yl]nitrous amide
Molecular Formula	C19H23N3O
Molecular Weight	309.4
XLogP	4.3
Topological Polar Surface Area	35.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Heavy Atom Count	23
Formal Charge	0
Complexity	343

SMILES

C1CN(CCC1N(C2=CC=CC=C2)N=O)CCC3=CC=CC=C3

InChI

InChI=1S/C19H23N3O/c23-20-22(18-9-5-2-6-10-18)19-12-15-21(16-13-19)14-11-17-7-3-1-4-8-17/h1-10,19H,11-16H2

InChIKey

UGNVRVNGWBYVPQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1184873-14-0

CID: 176478564

Formula: C19H23N3O

MW: 309.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	309.4
XLogP3	4.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	5
Exact Mass	309.184112366
Monoisotopic Mass	309.184112366
Topological Polar Surface Area	35.9 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	343
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-C051816-01	Ceritinib Nitroso Impurity 16
RM-G051429-01	Gentamicin Nitroso Impurity 16
RM-L160516-01	Loperamide Nitroso Impurity 16
RM-Z011416-01	Zanubrutinib Nitroso Impurity 16
RM-M180916-01	Morphine Nitroso Impurity 16
RM-T081542-01	Theophylline Nitroso Impurity 16
RM-C122916-01	Clonidine Nitroso Impurity 16
RM-V090316-01	Vincristine Nitroso Impurity 16
RM-P081316-01	Phentolamine Mesylate Nitroso Impurity 16
RM-F201410-01	Fentanyl EP Impurity A (controlled substance)

Catalog	Name
CS-EO-02652	N-Nitroso Fentanyl Impurity 1
CS-O-52850	N-Nitroso Butyryl Fentanyl Impurity
CS-EO-02655	N-Nitroso Fentanyl EP Impurity B
CS-EO-02595	N-Nitroso Fentanyl EP Impurity D
CS-EO-02594	N-Nitroso Fentanyl EP Impurity J
CS-O-52847	N-Nitroso-Para-Fluoro furanyl fentanyl impurity
CS-EO-02654	N-Nitroso Fentanyl Impurity 3 (Mixture of isomers)
CS-O-52846	N-Nitroso-2-Fluoro propionyl fentanyl impurity
CS-O-52837	N-Nitroso-p-Methyl propionyl fentanyl impurity
CS-EO-02653	N-Nitroso Fentanyl Impurity 2 (Mixture of Isomers)