8-Fluoroquinoline-4-carbaldehyde

CAT: 0926-WUA79230-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-WUA79230-01Size:50 mg

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CAS Number

496792-30-4

MDL Number

MFCD06824407

Smiles

C1=CC2=C (C=CN=C2C (=C1) F) C=O

Molecular Formula

C10H6FNO

Molecular Weight

175.16 g/mol

Controlled

Chemical Information

8-Fluoroquinoline-4-carbaldehyde

CAS Number	496792-30-4
PubChem CID	17975786
IUPAC Name	8-fluoroquinoline-4-carbaldehyde
Molecular Formula	C10H6FNO
Molecular Weight	175.16
XLogP	2
Topological Polar Surface Area	30
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	197

SMILES

C1=CC2=C(C=CN=C2C(=C1)F)C=O

InChI

InChI=1S/C10H6FNO/c11-9-3-1-2-8-7(6-13)4-5-12-10(8)9/h1-6H

InChIKey

XYBPBFLPLZOLGA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 496792-30-4

CID: 17975786

Formula: C10H6FNO

MW: 175.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	175.16
XLogP3	2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	175.043341977
Monoisotopic Mass	175.043341977
Topological Polar Surface Area	30 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	197
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

Catalog	Name
KAC65731-01	5-Fluoroquinoline-8-carbaldehyde
EZB79542-01	8-Fluoroquinoline-6-carbaldehyde
XAA93442-01	6-Fluoroquinoline-8-carbaldehyde
LKC34944-01	7-Fluoroquinoline-8-carbaldehyde
IAC63854-01	8-Fluoroquinoline-3-carbaldehyde
SSB91459-01	8-Bromo-5-fluoroquinoline-2-carbaldehyde
VGC79353-01	8-Bromo-7-fluoroquinoline-2-carbaldehyde
GMD77998-01	5-Bromo-7-fluoroquinoline-8-carbaldehyde
KXB76817-01	5-Fluoroquinoline-6-carbaldehyde
FF54377	8-Fluoroquinoline

Catalog	Name
PC1002489-01	8-Fluoroquinoline-4-carbaldehyde
PC110185	8-Fluoroquinoline-6-carbaldehyde
sc-475959A	8-Fluoroquinoline-2-carbaldehyde
PC1014224-01	8-Fluoroquinoline-5-carbaldehyde
PC107758	5-Fluoroquinoline-8-carbaldehyde
PC1003813-01	3-Fluoroquinoline-4-carbaldehyde
234994-01	8-Fluoroquinoline-2-carbaldehyde ≥95% (NMR)
PC1018754-01	5-bromo-8-fluoroquinoline-7-carbaldehyde
PC1019716-01	6-bromo-8-fluoroquinoline-7-carbaldehyde
sc-290082	4-Bromo-8-fluoroquinoline