3- (2-iodoethyl) oxetane

CAT: 0926-HWC57796-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-HWC57796-01Size:50 mg

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CAS Number

1782577-96-1

MDL Number

MFCD20486578

Smiles

C1C (CO1) CCI

Molecular Formula

C5H9IO

Molecular Weight

212 g/mol

Controlled

Chemical Information

3-(2-Iodoethyl)oxetane

CAS Number	1782577-96-1
PubChem CID	84678856
IUPAC Name	3-(2-iodoethyl)oxetane
Molecular Formula	C5H9IO
Molecular Weight	212.03
XLogP	1.8
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	7
Formal Charge	0
Complexity	52

SMILES

C1C(CO1)CCI

InChI

InChI=1S/C5H9IO/c6-2-1-5-3-7-4-5/h5H,1-4H2

InChIKey

UBVFXMJKTDGOFX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1782577-96-1

CID: 84678856

Formula: C5H9IO

MW: 212.03

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	212.03
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	211.96981
Monoisotopic Mass	211.96981
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	52
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
XYC45278-01	2- (2-Iodoethyl) oxetane
DQB01377-01	3- (iodomethyl) oxetane
SID62873-01	3- (2-Bromoethoxy) oxetane
BKA92246	3- (2-Hydroxyethyl) oxetane
PZC05826-01	3- (2-Iodoethyl) pyridine hydroiodide
FDA20335	(2-Iodoethyl) cyclohexane
KNA44919	(2-Iodoethyl) cyclopropane
LCD31909-01	(2-Iodoethyl) cyclobutane
KDC23413-01	Oxetane-3-sulfonamide
NCC73908-01	3- (Nitromethyl) oxetane