SU5205

CAT: 0926-DAA47686-04Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-DAA47686-04Size:100 mg

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

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CAS Number

3476-86-6

MDL Number

MFCD00435356

Smiles

C1=CC=C2C (=C1) /C (=C\C3=CC=C (C=C3) F) /C (=O) N2

Molecular Formula

C15H10FNO

Molecular Weight

239.24 g/mol

Controlled

Chemical Information

3-(4-Fluorobenzylidene)indolin-2-one

CAS Number	3476-86-6
PubChem CID	5398217
IUPAC Name	(3Z)-3-[(4-fluorophenyl)methylidene]-1H-indol-2-one
Molecular Formula	C15H10FNO
Molecular Weight	239.24
XLogP	3
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	18
Formal Charge	0
Complexity	358

SMILES

C1=CC=C2C(=C1)/C(=C/C3=CC=C(C=C3)F)/C(=O)N2

InChI

InChI=1S/C15H10FNO/c16-11-7-5-10(6-8-11)9-13-12-3-1-2-4-14(12)17-15(13)18/h1-9H,(H,17,18)/b13-9-

InChIKey

QIERHADIMMFZNE-LCYFTJDESA-N

Chemical Structure

2D Structure

CAS: 3476-86-6

CID: 5398217

Formula: C15H10FNO

MW: 239.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	239.24
XLogP3	3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	239.074642105
Monoisotopic Mass	239.074642105
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	358
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
BUP14194	SU5205