(2,4-Difluorophenyl) (morpholino) methanone

CAT: 0127-PC1022448-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1022448-01Size:250 mg

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CAS Number

948717-49-5

MDL Number

MFCD11725681

Purity

97%

Smiles

C1c (cc (c (c1) C (=O) N1CCOCC1) F) F

Chemical Information

(2,4-Difluorophenyl)(morpholino)methanone

CAS Number	948717-49-5
PubChem CID	17683286
IUPAC Name	(2,4-difluorophenyl)-morpholin-4-ylmethanone
Molecular Formula	C11H11F2NO2
Molecular Weight	227.21
XLogP	1.2
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Heavy Atom Count	16
Formal Charge	0
Complexity	256

SMILES

C1COCCN1C(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C11H11F2NO2/c12-8-1-2-9(10(13)7-8)11(15)14-3-5-16-6-4-14/h1-2,7H,3-6H2

InChIKey

HPYMDXQIGVFBBU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 948717-49-5

CID: 17683286

Formula: C11H11F2NO2

MW: 227.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	227.21
XLogP3	1.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	227.07578492
Monoisotopic Mass	227.07578492
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	256
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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