3- (Thiophen-2-yl) thiomorpholine

CAT: 0926-IMB72514-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-IMB72514-01Size:50 mg

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CAS Number

933725-14-5

MDL Number

MFCD16302499

Smiles

C1CSCC (N1) C2=CC=CS2

Molecular Formula

C8H11NS2

Molecular Weight

185.3 g/mol

Controlled

Chemical Information

3-(2-Thienyl)thiomorpholine

CAS Number	933725-14-5
PubChem CID	60727914
IUPAC Name	3-thiophen-2-ylthiomorpholine
Molecular Formula	C8H11NS2
Molecular Weight	185.3
XLogP	1.5
Topological Polar Surface Area	65.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	129

SMILES

C1CSCC(N1)C2=CC=CS2

InChI

InChI=1S/C8H11NS2/c1-2-8(11-4-1)7-6-10-5-3-9-7/h1-2,4,7,9H,3,5-6H2

InChIKey

VLALEQCRKOSSHW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 933725-14-5

CID: 60727914

Formula: C8H11NS2

MW: 185.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	185.3
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	185.03329170
Monoisotopic Mass	185.03329170
Topological Polar Surface Area	65.6 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	129
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
YGC02770-01	3-{[3- (Thiophen-3-yl) -1,2,4-oxadiazol-5-yl]methyl}thiomorpholine hydrochloride
UDC30684-01	3- (5-Methylfuran-2-yl) thiomorpholine
IMB70185-01	3- (1,3-Thiazol-2-yl) thiomorpholine
EEC94945-01	2- (Propan-2-yl) thiomorpholine
LEA41097-01	3- (Thiophen-2-yl) morpholine
XZB39206-01	2- (Thiophen-3-yl) morpholine
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TCA27738-01	2- (Thiophen-3-yl) oxirane
NAA78166-01	2- (Thiophen-3-yl) acetamide
EBA88666-01	3- (Thiophen-2-yl) phenol

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