C527

CAT: 0127-BUP06265-04Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP06265-04Size:50 mg

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

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CAS Number

192718-06-2

Purity

=95%

Smiles

Fc1ccc(cc1)-c1nc2c(o1)C(=O)c1ccccc1C2=O

Chemical Information

2-(4-Fluorophenyl)naphtho[2,3-d]oxazole-4,9-dione

CAS Number	192718-06-2
PubChem CID	2307331
IUPAC Name	2-(4-fluorophenyl)benzo[f][1,3]benzoxazole-4,9-dione
Molecular Formula	C17H8FNO3
Molecular Weight	293.25
XLogP	3.7
Topological Polar Surface Area	60.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Heavy Atom Count	22
Formal Charge	0
Complexity	475

SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)OC(=N3)C4=CC=C(C=C4)F

InChI

InChI=1S/C17H8FNO3/c18-10-7-5-9(6-8-10)17-19-13-14(20)11-3-1-2-4-12(11)15(21)16(13)22-17/h1-8H

InChIKey

ULJDFEYQOPCCPM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 192718-06-2

CID: 2307331

Formula: C17H8FNO3

MW: 293.25

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	293.25
XLogP3	3.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	293.04882128
Monoisotopic Mass	293.04882128
Topological Polar Surface Area	60.2 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	475
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