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N- (Hydroxymethyl) phthalimide

CAT: 0063-16823649-1kgSize: 1 KgDry Ice: NoHazardous: No
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CAS Number
118-29-6
Molecular Formula
C9H7NO3
Molecular Weight
177.16
Formulation
C9H7NO3

Chemical Information

N-(hydroxymethyl)phthalimide

N-(hydroxymethyl)phthalimide is a primary alcohol comprising phthalimide carrying an N-hydroxymethyl substituent. It is a primary alcohol and a member of phthalimides. It is functionally related to a phthalimide.

CAS Number118-29-6
PubChem CID8354
IUPAC Name2-(hydroxymethyl)isoindole-1,3-dione
Molecular FormulaC9H7NO3
Molecular Weight177.16
XLogP1.5
Topological Polar Surface Area57.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count13
Formal Charge0
Complexity227
SMILES
C1=CC=C2C(=C1)C(=O)N(C2=O)CO
InChI
InChI=1S/C9H7NO3/c11-5-10-8(12)6-3-1-2-4-7(6)9(10)13/h1-4,11H,5H2
InChIKey
MNSGOOCAMMSKGI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(hydroxymethyl)phthalimide
CAS: 118-29-6
CID: 8354
Formula: C9H7NO3
MW: 177.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight177.16
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass177.042593085
Monoisotopic Mass177.042593085
Topological Polar Surface Area57.6 Ų
Heavy Atom Count13
Formal Charge0
Complexity227
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
FH33638-01N- (Hydroxymethyl) phthalimide
1425I 00100N- (Hydroxymethyl) Phthalimide 96%
H14740-01N- (Hydroxymethyl) phthalimide 97%
FP31525-01Phthalimide
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116820 500Phthalimide for Synthesis
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