Alconil

CAT: 0127-BUP08235-02Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP08235-02Size:10 mg

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

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CAS Number

97677-19-5

Synonyms

Al 1567, Al1567, Al-1567

Purity

=98%

Smiles

O=C1NC(=O)C2(N1)C=3C=CC=CC3C4=CC=C(F)C=C42

Chemical Information

Alconil

structure given in first source

CAS Number	97677-19-5
PubChem CID	119155
IUPAC Name	2-fluorospiro[fluorene-9,5'-imidazolidine]-2',4'-dione
Molecular Formula	C15H9FN2O2
Molecular Weight	268.24
XLogP	1.9
Topological Polar Surface Area	58.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	20
Formal Charge	0
Complexity	469

SMILES

C1=CC=C2C(=C1)C3=C(C24C(=O)NC(=O)N4)C=C(C=C3)F

InChI

InChI=1S/C15H9FN2O2/c16-8-5-6-10-9-3-1-2-4-11(9)15(12(10)7-8)13(19)17-14(20)18-15/h1-7H,(H2,17,18,19,20)

InChIKey

JRGBXEJDIMXJAP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 97677-19-5

CID: 119155

Formula: C15H9FN2O2

MW: 268.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	268.24
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	268.06480570
Monoisotopic Mass	268.06480570
Topological Polar Surface Area	58.2 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	469
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

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Catalog	Name
T29844-01	Alconil