2-fluoro-6-propoxybenzaldehyde

CAT: 0127-PC1012461-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1012461-01Size:250 mg

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CAS Number

1692207-96-7

MDL Number

MFCD34784242

Purity

95%

Smiles

C1ccc (c (c1F) C=O) OCCC

Chemical Information

2-Fluoro-6-propoxybenzaldehyde

CAS Number	1692207-96-7
PubChem CID	108302557
IUPAC Name	2-fluoro-6-propoxybenzaldehyde
Molecular Formula	C10H11FO2
Molecular Weight	182.19
XLogP	2.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	161

SMILES

CCCOC1=C(C(=CC=C1)F)C=O

InChI

InChI=1S/C10H11FO2/c1-2-6-13-10-5-3-4-9(11)8(10)7-12/h3-5,7H,2,6H2,1H3

InChIKey

YJVZAUWNRCGXQP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1692207-96-7

CID: 108302557

Formula: C10H11FO2

MW: 182.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	182.19
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	182.07430775
Monoisotopic Mass	182.07430775
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	161
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
PC1017302-01	3-Fluoro-6-methyl-2-propoxybenzaldehyde
PC1022933	6-Bromo-2-fluoro-3-propoxybenzaldehyde
PC1016772	2-Fluoro-3-methyl-6-propoxybenzaldehyde
PC99042-01	2-Bromo-6-fluoro-3-propoxybenzaldehyde
PC1016422	2-Fluoro-3-propoxybenzaldehyde
PC1008944-01	2-Fluoro-5-propoxybenzaldehyde
PC1014242	5-Fluoro-2-propoxybenzaldehyde
PC1022171	4-Fluoro-2-n-propoxybenzaldehyde
PC1022696	2-Fluoro-4-n-propoxybenzaldehyde
PC1022153	3-fluoro-5-propoxybenzaldehyde

Catalog	Name
sc-265860	2-n-Propoxybenzaldehyde
NCA66747-01	2-Hydroxy-4-propoxybenzaldehyde
sc-284598	5-chloro-2-propoxybenzaldehyde
sc-283844	3-propoxybenzaldehyde
IKB53190-01	2-Methyl-4-propoxybenzaldehyde
430867-01	4-Bromo-2-propoxybenzaldehyde
sc-276217	3-ethoxy-2-propoxybenzaldehyde
sc-284552	5-bromo-2-propoxybenzaldehyde
sc-347395A	3,5-dibromo-2-propoxybenzaldehyde
sc-232973	4-Propoxybenzaldehyde