VGX-1027

CAT: 0127-OR1026551-02Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1026551-02Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

6501-72-0

Synonyms

2- (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl) acetic acid

Purity

98%

Smiles

C1C(ON=C1C2=CC=CC=C2)CC(=O)O

Chemical Information

Zenuzolac

CAS Number	6501-72-0
PubChem CID	10798271
IUPAC Name	2-(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)acetic acid
Molecular Formula	C11H11NO3
Molecular Weight	205.21
XLogP	1.3
Topological Polar Surface Area	58.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Heavy Atom Count	15
Formal Charge	0
Complexity	269

SMILES

C1C(ON=C1C2=CC=CC=C2)CC(=O)O

InChI

InChI=1S/C11H11NO3/c13-11(14)7-9-6-10(12-15-9)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,13,14)

InChIKey

MUFJHYRCIHHATF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 6501-72-0

CID: 10798271

Formula: C11H11NO3

MW: 205.21

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	205.21
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	205.07389321
Monoisotopic Mass	205.07389321
Topological Polar Surface Area	58.9 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	269
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes