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1- (Methylamino) Hexan-3-One

CAT: 1299-RG-A261861-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RG-A261861-02Size:25 mg
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CAS Number
32373-08-3
Synonyms
1- (methylamino) hexan-3-one
Molecular Formula
C7H15NO
Molecular Weight
129.2
Product Name Synonym
1- (methylamino) hexan-3-one

Chemical Information

1-(Methylamino)hexan-3-one
CAS Number32373-08-3
PubChem CID419587
IUPAC Name1-(methylamino)hexan-3-one
Molecular FormulaC7H15NO
Molecular Weight129.20
XLogP0.3
Topological Polar Surface Area29.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count9
Formal Charge0
Complexity81
SMILES
CCCC(=O)CCNC
InChI
InChI=1S/C7H15NO/c1-3-4-7(9)5-6-8-2/h8H,3-6H2,1-2H3
InChIKey
QEUBJQRUGGMZRC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(Methylamino)hexan-3-one
CAS: 32373-08-3
CID: 419587
Formula: C7H15NO
MW: 129.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight129.20
XLogP30.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass129.115364102
Monoisotopic Mass129.115364102
Topological Polar Surface Area29.1 Ų
Heavy Atom Count9
Formal Charge0
Complexity81
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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