2-Cyclobutoxythiazole

CAT: 0127-OR1044418-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1044418-01Size:100 mg

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CAS Number

2177025-95-3

MDL Number

MFCD31573116

Purity

95%

Smiles

C1(OC2CCC2)=NC=CS1

Chemical Information

2-Cyclobutoxythiazole

CAS Number	2177025-95-3
PubChem CID	126953979
IUPAC Name	2-cyclobutyloxy-1,3-thiazole
Molecular Formula	C7H9NOS
Molecular Weight	155.22
XLogP	2.2
Topological Polar Surface Area	50.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	116

SMILES

C1CC(C1)OC2=NC=CS2

InChI

InChI=1S/C7H9NOS/c1-2-6(3-1)9-7-8-4-5-10-7/h4-6H,1-3H2

InChIKey

DXCFGNHVHUOBGI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2177025-95-3

CID: 126953979

Formula: C7H9NOS

MW: 155.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	155.22
XLogP3	2.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	155.04048508
Monoisotopic Mass	155.04048508
Topological Polar Surface Area	50.4 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	116
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

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