8-Bromo-1-fluorophenazine

CAT: 0127-PC57775-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC57775-01Size:250 mg

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CAS Number

2379918-33-7

Synonyms

3-Bromo-6-fluorophenazine

MDL Number

MFCD32070710

Purity

94%

Smiles

Fc1cccc2nc3ccc(Br)cc3nc12

Chemical Information

8-Bromo-1-fluorophenazine

CAS Number	2379918-33-7
PubChem CID	145913782
IUPAC Name	8-bromo-1-fluorophenazine
Molecular Formula	C12H6BrFN2
Molecular Weight	277.09
XLogP	3.4
Topological Polar Surface Area	25.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	16
Formal Charge	0
Complexity	263

SMILES

C1=CC2=C(C(=C1)F)N=C3C=C(C=CC3=N2)Br

InChI

InChI=1S/C12H6BrFN2/c13-7-4-5-9-11(6-7)16-12-8(14)2-1-3-10(12)15-9/h1-6H

InChIKey

LKFLBGBRCUPJIF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2379918-33-7

CID: 145913782

Formula: C12H6BrFN2

MW: 277.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	277.09
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	275.96984
Monoisotopic Mass	275.96984
Topological Polar Surface Area	25.8 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	263
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