(5-Phenylthiomorpholin-3-yl) methanol

CAT: 0926-QCC36600-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-QCC36600-01Size:50 mg

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CAS Number

1315366-00-7

MDL Number

MFCD19382270

Smiles

C1C (NC (CS1) C2=CC=CC=C2) CO

Molecular Formula

C11H15NOS

Molecular Weight

209.31 g/mol

Controlled

Chemical Information

(5-Phenylthiomorpholin-3-yl)methanol

CAS Number	1315366-00-7
PubChem CID	54594302
IUPAC Name	(5-phenylthiomorpholin-3-yl)methanol
Molecular Formula	C11H15NOS
Molecular Weight	209.31
XLogP	1.1
Topological Polar Surface Area	57.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	14
Formal Charge	0
Complexity	171

SMILES

C1C(NC(CS1)C2=CC=CC=C2)CO

InChI

InChI=1S/C11H15NOS/c13-6-10-7-14-8-11(12-10)9-4-2-1-3-5-9/h1-5,10-13H,6-8H2

InChIKey

UWFUIBSJCDOJPV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1315366-00-7

CID: 54594302

Formula: C11H15NOS

MW: 209.31

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	209.31
XLogP3	1.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	209.08743528
Monoisotopic Mass	209.08743528
Topological Polar Surface Area	57.6 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	171
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
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JWC13006-01	(3,5,5-Trimethylmorpholin-3-yl) methanol
GEC33873-01	(5,5-difluoropiperidin-3-yl) methanol hcl

Catalog	Name
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OR1093712	(5-Bromothiophen-3-yl) methanol
OR93998-01	(5-Aminopyridin-3-yl) methanol
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OR932347-01	(5-Methylpyridin-3-yl) methanol
GTR19252617-01	(5-Phenylisoxazol-3-yl) methanol
GTR19252246-01	(3-Methylisoxazol-5-yl) methanol
436610-01	(5-Fluoropyridin-3-yl) methanol
sc-290928	(5-isopropylisoxazol-3-yl) methanol