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4-Hydroxy-N-methylbutanamide

CAT: 0572-TRC-H943835-1GSize: 1 gDry Ice: NoHazardous: No
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CAT#:0572-TRC-H943835-1GSize:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
37941-69-8
Synonyms
N-Methyl-γ-hydroxybutyramide; 4-Hydroxy-N-methylbutanamide
Hazard Statement
Causes skin irritation
Purity
>95% (HPLC)
Smiles
CNC(=O)CCCO
Molecular Formula
C5 H11 N O2
Molecular Weight
117.15
InChI
InChI=1S/C5H11NO2/c1-6-5(8)3-2-4-7/h7H,2-4H2,1H3,(H,6,8)
Additionnal Information
IUPAC name: 4-hydroxy-N-methyl-butanamide
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Butanamide, 4-hydroxy-N-methyl-
CAS Number37941-69-8
PubChem CID169986
IUPAC Name4-hydroxy-N-methylbutanamide
Molecular FormulaC5H11NO2
Molecular Weight117.15
XLogP-0.9
Topological Polar Surface Area49.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count8
Formal Charge0
Complexity72
SMILES
CNC(=O)CCCO
InChI
InChI=1S/C5H11NO2/c1-6-5(8)3-2-4-7/h7H,2-4H2,1H3,(H,6,8)
InChIKey
DLKOPXVSDZXMRM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butanamide, 4-hydroxy-N-methyl-
CAS: 37941-69-8
CID: 169986
Formula: C5H11NO2
MW: 117.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight117.15
XLogP3-0.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass117.078978594
Monoisotopic Mass117.078978594
Topological Polar Surface Area49.3 Ų
Heavy Atom Count8
Formal Charge0
Complexity72.8
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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