Retrofractamide C

CAT: 0013-GTR19236855-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19236855-01Size:50 mg

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Description

The fruits of Piper nigrum L.

CAS Number

96386-33-3

Purity

>98% (HPLC)

Solubility

DMSO, Pyridine, Methanol, Ethanol, etc.

Molecular Formula

C20H27NO3

Molecular Weight

329.4

Storage Conditions

Storage temperature: -20°C. Stability: ≥ 2 years

Notes

For research use only.

Chemical Information

Retrofractamide C

Retrofractamide C is a member of benzodioxoles.

CAS Number	96386-33-3
PubChem CID	25255091
IUPAC Name	(2E,8E)-9-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)nona-2,8-dienamide
Molecular Formula	C20H27NO3
Molecular Weight	329.4
XLogP	5.4
Topological Polar Surface Area	47.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	9
Heavy Atom Count	24
Formal Charge	0
Complexity	431

SMILES

CC(C)CNC(=O)/C=C/CCCC/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C20H27NO3/c1-16(2)14-21-20(22)10-8-6-4-3-5-7-9-17-11-12-18-19(13-17)24-15-23-18/h7-13,16H,3-6,14-15H2,1-2H3,(H,21,22)/b9-7+,10-8+

InChIKey

PAXQNYHJDFKFEU-FIFLTTCUSA-N

Chemical Structure

2D Structure

$2D structure of Retrofractamide C$

CAS: 96386-33-3

CID: 25255091

Formula: C20H27NO3

MW: 329.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	329.4
XLogP3	5.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	9
Exact Mass	329.19909372
Monoisotopic Mass	329.19909372
Topological Polar Surface Area	47.6 Å²
Heavy Atom Count	24
Formal Charge	0
Complexity	431
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
HY-N12120-01	Retrofractamide A
AB2860	Retrofractamide B
M32662-01	Retrofractamide C
M32652-01	Pipercide (Retrofractamide B)

Retrofractamide C

Chemical Information

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