4- (Thiophen-2-ylmethyl) morpholine

CAT: 0127-OR960178-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR960178-01Size:1 g

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CAS Number

338454-48-1

MDL Number

MFCD01309097

Purity

98%

Smiles

C(N1CCOCC1)c2cccs2

Chemical Information

4-(Thiophen-2-ylmethyl)morpholine

CAS Number	338454-48-1
PubChem CID	240843
IUPAC Name	4-(thiophen-2-ylmethyl)morpholine
Molecular Formula	C9H13NOS
Molecular Weight	183.27
XLogP	1.1
Topological Polar Surface Area	40.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	136

SMILES

C1COCCN1CC2=CC=CS2

InChI

InChI=1S/C9H13NOS/c1-2-9(12-7-1)8-10-3-5-11-6-4-10/h1-2,7H,3-6,8H2

InChIKey

WUURQTRNCPVWAU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 338454-48-1

CID: 240843

Formula: C9H13NOS

MW: 183.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	183.27
XLogP3	1.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	183.07178521
Monoisotopic Mass	183.07178521
Topological Polar Surface Area	40.7 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	136
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
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Catalog	Name
BDA17549-01	2- (Thiophen-2-yl) morpholine
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sc-314995	4- (Pyrrolidin-2-ylmethyl) morpholine
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