Pseudopelletierine oxime

CAT: 0024-sc-483585Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-483585Size:1 g

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CAS Number

6164-67-6

Chemical Information

9-Methyl-9-azabicyclo[3.3.1]nonan-3-one oxime

CAS Number	6164-67-6
PubChem CID	3219133
IUPAC Name	N-(9-methyl-9-azabicyclo[3.3.1]nonan-3-ylidene)hydroxylamine
Molecular Formula	C9H16N2O
Molecular Weight	168.24
XLogP	1
Topological Polar Surface Area	35.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	12
Formal Charge	0
Complexity	187

SMILES

CN1C2CCCC1CC(=NO)C2

InChI

InChI=1S/C9H16N2O/c1-11-8-3-2-4-9(11)6-7(5-8)10-12/h8-9,12H,2-6H2,1H3

InChIKey

PUMZOLVVVUXXHJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6164-67-6

CID: 3219133

Formula: C9H16N2O

MW: 168.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	168.24
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	168.126263138
Monoisotopic Mass	168.126263138
Topological Polar Surface Area	35.8 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	187
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-212603	Pseudopelletierine
sc-353160A	Cyclohexanone oxime
sc-207633C	Erythromycin Oxime
sc-472740	Thiazolylacetylglycine Oxime
sc-233807	Acetophenone oxime
sc-239188	Acetone oxime
sc-338711	Tetralone oxime
sc-391533	Erythromycin A oxime
sc-487028	Cyclopentadecanone Oxime
sc-353160	Cyclohexanone oxime

Catalog	Name
OR951413-01	Pseudopelletierine oxime
TRC-P839600-10MG	Pseudopelletierine
T124545-01	Pseudopelletierine hydrochloride
MBS5772856	Pseudopelletierine free base
AR-A05772-01	Aflatoxin B1-oxime (AFB1-oxime)
AR-A05770-01	Aflatoxin M1-oxime (AFM1-oxime)
M015-10MG	Milbemycin oxime
FD145705-01	Deoxybenzoic oxime
CAA15831	Cycloheptanone Oxime
HY-118793-01	Inosine oxime