N- (Propargyloxy) phthalimide

CAT: 0024-sc-235956Size: 10 gDry Ice: NoHazardous: No

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CAT#:0024-sc-235956Size:10 g

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CAS Number

4616-63-1

Chemical Information

N-(prop-2-ynyloxy)phthalimide

CAS Number	4616-63-1
PubChem CID	78357
IUPAC Name	2-prop-2-ynoxyisoindole-1,3-dione
Molecular Formula	C11H7NO3
Molecular Weight	201.18
XLogP	1.5
Topological Polar Surface Area	46.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	317

SMILES

C#CCON1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C11H7NO3/c1-2-7-15-12-10(13)8-5-3-4-6-9(8)11(12)14/h1,3-6H,7H2

InChIKey

HBGZBVPXPDNXOV-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4616-63-1

CID: 78357

Formula: C11H7NO3

MW: 201.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	201.18
XLogP3	1.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	201.042593085
Monoisotopic Mass	201.042593085
Topological Polar Surface Area	46.6 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	317
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
sc-228646	N- (Phenylthio) phthalimide
sc-253084	N- (Phenylseleno) phthalimide
sc-228646A	N- (Phenylthio) phthalimide
sc-477867	N-Phthalimide-linagliptin
sc-253082	N- (Hydroxymethyl) phthalimide
sc-250435	N- (Bromomethyl) phthalimide
sc-253084A	N- (Phenylseleno) phthalimide
sc-487011	N- (Cyclohexylthio) phthalimide
sc-219096	N-Cyclopropylmethoxy-phthalimide
sc-253079	N- (Chloromethyl) phthalimide

Catalog	Name
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PC50075	Potassium [ (propargyloxy) methyl]trifluoroborate
CS-T-84178	Phthalimide-d4
116820 500	Phthalimide for Synthesis
TRC-P698300-25G	Potassium Phthalimide