(5R) -5- (1-Methylethyl) -3-morpholinone

CAT: 0127-OR80078-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR80078-01Size:100 mg

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CAS Number

1007113-31-6

MDL Number

MFCD22533874

Purity

97%

Smiles

O=C1N[C@H](C(C)C)COC1

Chemical Information

(R)-5-isopropylmorpholin-3-one

CAS Number	1007113-31-6
PubChem CID	51357136
IUPAC Name	(5R)-5-propan-2-ylmorpholin-3-one
Molecular Formula	C7H13NO2
Molecular Weight	143.18
XLogP	0.6
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	134

SMILES

CC(C)[C@@H]1COCC(=O)N1

InChI

InChI=1S/C7H13NO2/c1-5(2)6-3-10-4-7(9)8-6/h5-6H,3-4H2,1-2H3,(H,8,9)/t6-/m0/s1

InChIKey

DGOLJYXTOMTIEE-LURJTMIESA-N

Chemical Structure

2D Structure

CAS: 1007113-31-6

CID: 51357136

Formula: C7H13NO2

MW: 143.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	143.18
XLogP3	0.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	143.094628657
Monoisotopic Mass	143.094628657
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	134
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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
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MBS6072716-01	(5R,6R)-6-[(1R)-1-[3,5-Bis(trifluoromethyl)phenyl]ethoxy]-5-(4-fluorophenyl)-3-morpholinone
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