Morpholin-3-one

CAT: 0127-OR301177-02Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR301177-02Size:25 g

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CAS Number

109-11-5

Synonyms

3-Oxomorpholine

MDL Number

MFCD00631009

Purity

=95%

Smiles

O=C1COCCN1

Chemical Information

3-Morpholinone

CAS Number	109-11-5
PubChem CID	66953
IUPAC Name	morpholin-3-one
Molecular Formula	C4H7NO2
Molecular Weight	101.10
XLogP	-0.8
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	81

SMILES

C1COCC(=O)N1

InChI

InChI=1S/C4H7NO2/c6-4-3-7-2-1-5-4/h1-3H2,(H,5,6)

InChIKey

VSEAAEQOQBMPQF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 109-11-5

CID: 66953

Formula: C4H7NO2

MW: 101.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	101.10
XLogP3	-0.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	101.047678466
Monoisotopic Mass	101.047678466
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	81.8
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
OR73360-01	Morpholin-2-one
OR926444-01	Morpholin-3-ylmethanol
OR76581-01	(S) -Morpholin-3-ylmethanol
OR308163-01	Morpholin-3-ylmethanol hydrochloride
OR96379-01	N-Boc morpholin-2-one
OR24065	3- (Morpholin-4-yl) -3-oxopropanenitrile
OR84504-01	3- (Morpholin-4-yl) -3-oxopropanethioamide
BUP23490-01	3-Morpholin-4-ylmethyl-benzylamine
OR1383-01	3- (Morpholin-4-yl) aniline
OR30125-01	3- (Morpholin-4-yl) phenol

Catalog	Name
RG-M151802-01	Morpholin-3-One
LCA63632	N-Benzyl-morpholin-3-one
JSD45809-01	6- (Diethoxymethyl) morpholin-3-one
LYB58212-01	5- (Trifluoromethyl) morpholin-3-one
EMB01995-01	6- (Hydroxymethyl) morpholin-3-one
EEC95395-01	6- (Trifluoromethyl) morpholin-3-one
AR-R01826-01	4- (3-nitrophenyl) morpholin-3-one
NPC26041-01	2- (Hydroxymethyl) morpholin-3-one
NKD23260-01	2- (Bromomethyl) morpholin-3-one
HTB49522-01	4- (3-Aminophenyl) morpholin-3-one