2,5-Difluorobenzaldehyde

CAT: 0024-sc-231096Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-231096Size:1 g

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CAS Number

2646-90-4

Chemical Information

2,5-Difluorobenzaldehyde

CAS Number	2646-90-4
PubChem CID	137663
IUPAC Name	2,5-difluorobenzaldehyde
Molecular Formula	C7H4F2O
Molecular Weight	142.10
XLogP	1.8
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	127

SMILES

C1=CC(=C(C=C1F)C=O)F

InChI

InChI=1S/C7H4F2O/c8-6-1-2-7(9)5(3-6)4-10/h1-4H

InChIKey

VVVOJODFBWBNBI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2646-90-4

CID: 137663

Formula: C7H4F2O

MW: 142.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.10
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	142.02302107
Monoisotopic Mass	142.02302107
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	127
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
sc-238688	3,5-Difluorobenzaldehyde
sc-231190	2,6-Difluorobenzaldehyde
sc-225677	2,4-Difluorobenzaldehyde
sc-230822	2,3-Difluorobenzaldehyde
sc-504932	4-Chloro-3,5-difluorobenzaldehyde
sc-260752	3-Bromo-2,6-difluorobenzaldehyde
sc-277145	4-Bromo-2,6-difluorobenzaldehyde
sc-266556	3-Chloro-2,4-difluorobenzaldehyde
sc-357732A	4-Ethoxy-2,3-difluorobenzaldehyde
sc-357695	4-Bromo-2,3-difluorobenzaldehyde

Catalog	Name
PC48832-01	2,5-Difluorobenzaldehyde
PC1022307-01	2,5-difluorobenzaldehyde oxime
424244-01	3-Bromo-2,5-difluorobenzaldehyde
PC1014684-01	5-ethoxy-2,4-difluorobenzaldehyde
PC56948-01	2-Chloro-3,5-difluorobenzaldehyde
PC49270-01	2-Bromo-4,5-difluorobenzaldehyde
PC904911-01	2-Chloro-4,5-difluorobenzaldehyde
PC1016724-01	4-Butoxy-2,5-difluorobenzaldehyde
PC1023052	2-Ethoxy-4,5-difluorobenzaldehyde
PC501964-01	2-Bromo-3,5-difluorobenzaldehyde