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4-(2,4-Diaminophenyl)-3-morpholinone

CAT: 0572-TRC-D416610-50MGSize: 50 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-D416610-50MGSize:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
482308-13-4
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
Nc1ccc(N2CCOCC2=O)c(N)c1
Molecular Formula
C10H13N3O2
Molecular Weight
207.23
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

4-(2,4-Diaminophenyl)morpholin-3-one
CAS Number482308-13-4
PubChem CID23105324
IUPAC Name4-(2,4-diaminophenyl)morpholin-3-one
Molecular FormulaC10H13N3O2
Molecular Weight207.23
XLogP-0.4
Topological Polar Surface Area81.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count15
Formal Charge0
Complexity247
SMILES
C1COCC(=O)N1C2=C(C=C(C=C2)N)N
InChI
InChI=1S/C10H13N3O2/c11-7-1-2-9(8(12)5-7)13-3-4-15-6-10(13)14/h1-2,5H,3-4,6,11-12H2
InChIKey
ILLFBLRLPINBMA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(2,4-Diaminophenyl)morpholin-3-one
CAS: 482308-13-4
CID: 23105324
Formula: C10H13N3O2
MW: 207.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight207.23
XLogP3-0.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass207.100776666
Monoisotopic Mass207.100776666
Topological Polar Surface Area81.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity247
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
428708-014- (2,4-Diaminophenyl) -3-morpholinone
EDA54512-012- (3,4-Diaminophenyl) acetonitrile
HUA30813-014- (2,4-Diaminophenyl) morpholin-3-one
AR-M05111-014- (2-Aminophenyl) -3-morpholinone
OR48993,4'-Diaminophenyl ether
OR310306(3,4-Diaminophenyl) methanol
285253-014- (4-Nitrophenyl) -3-morpholinone
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