4-Fluoro-1-naphthaldehyde

CAT: 0127-PC409500-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-PC409500-01Size:100 mg

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CAS Number

172033-73-7

MDL Number

MFCD02261765

Purity

98%

Smiles

Fc1ccc(C=O)c2ccccc12

Chemical Information

4-Fluoronaphthalene-1-carbaldehyde

CAS Number	172033-73-7
PubChem CID	7022524
IUPAC Name	4-fluoronaphthalene-1-carbaldehyde
Molecular Formula	C11H7FO
Molecular Weight	174.17
XLogP	2.7
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	193

SMILES

C1=CC=C2C(=C1)C(=CC=C2F)C=O

InChI

InChI=1S/C11H7FO/c12-11-6-5-8(7-13)9-3-1-2-4-10(9)11/h1-7H

InChIKey

LZUCGZVKZDBILP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 172033-73-7

CID: 7022524

Formula: C11H7FO

MW: 174.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	174.17
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	174.048093005
Monoisotopic Mass	174.048093005
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193
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
PC1020239-01	4-fluoro-3- (methoxymethyl) -1-naphthaldehyde
PC1018094-01	4-Fluoro-3-methyl-1-naphthaldehyde
PC1018288-01	1-Fluoro-4-iodo-2-naphthaldehyde
PC1018092-01	4-Fluoro-3- (methylthio) -1-naphthaldehyde
PC1026155	4-Bromo-1-fluoro-2-naphthaldehyde
PC5696-01	1-Fluoro-2-naphthaldehyde
PC2874-01	5-Fluoro-1-naphthaldehyde
PC1022005	4- (Difluoromethoxy) -1-naphthaldehyde
OR89995-01	4-Hydroxy-1-naphthaldehyde
OR1092177-01	4- (Methylthio) -1-naphthaldehyde

Catalog	Name
MBS6056986-01	4-Fluoro-1-naphthaldehyde
409769-01	1-Fluoro-2-naphthaldehyde
sc-262594A	5-Fluoro-1-naphthaldehyde
114250 500	1-Naphthaldehyde for Synthesis (α-Naphthaldehyde)
432595-01	4-Hydroxy-1-naphthaldehyde
283009-01	4-Methoxy-1-naphthaldehyde
IBA73848-01	4-Methyl-1-naphthaldehyde
sc-314915	4- (Cyclopropylmethoxy) -1-naphthaldehyde
sc-226617	4-Dimethylamino-1-naphthaldehyde
abx182902-01	1-Naphthaldehyde