Structure

2,6-Difluoro-4-methoxybenzaldehyde

CAS
256417-10-4
Catalog Number
ACM256417104
Category
Aryl Fluorinated Building Blocks
Molecular Weight
172.13
Molecular Formula
C8H6F2O2

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Specification

Synonyms
Ambap1304, 631809_ALDRICH, 2,6-Difluoro-4-methoxybenzaldehyde, JRD-1439, 256417-10-4
IUPAC Name
2,6-difluoro-4-methoxybenzaldehyde
Canonical SMILES
COC1=CC(=C(C(=C1)F)C=O)F
InChI Key
ZYABCGOTMDPUDD-UHFFFAOYSA-N
Boiling Point
207.1ºC at 760 mmHg
Melting Point
73-77ºC(lit.)
Flash Point
77.1ºC
Density
1.289g/cm³
Exact Mass
172.03400
Hazard Statements
H315-H319-H335
H-Bond Acceptor
4
H-Bond Donor
0
RIDADR
NONH for all modes of transport
Safety Description
26-36/37/39
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 2,6-Difluoro-4-methoxybenzaldehyde?

The molecular formula of 2,6-Difluoro-4-methoxybenzaldehyde is C8H6F2O2.

What is the molecular weight of 2,6-Difluoro-4-methoxybenzaldehyde?

The molecular weight of 2,6-Difluoro-4-methoxybenzaldehyde is 172.13 g/mol.

What is the IUPAC name of 2,6-Difluoro-4-methoxybenzaldehyde?

The IUPAC name of 2,6-Difluoro-4-methoxybenzaldehyde is 2,6-difluoro-4-methoxybenzaldehyde.

What is the InChI of 2,6-Difluoro-4-methoxybenzaldehyde?

The InChI of 2,6-Difluoro-4-methoxybenzaldehyde is InChI=1S/C8H6F2O2/c1-12-5-2-7(9)6(4-11)8(10)3-5/h2-4H,1H3.

How many hydrogen bond donor counts does 2,6-Difluoro-4-methoxybenzaldehyde have?

2,6-Difluoro-4-methoxybenzaldehyde has 0 hydrogen bond donor count.

What is the topological polar surface area of 2,6-Difluoro-4-methoxybenzaldehyde?

The topological polar surface area of 2,6-Difluoro-4-methoxybenzaldehyde is 26.3 Å2.

Is 2,6-Difluoro-4-methoxybenzaldehyde considered as a canonicalized compound?

Yes, 2,6-Difluoro-4-methoxybenzaldehyde is considered as a canonicalized compound.

What is the XLogP3-AA value of 2,6-Difluoro-4-methoxybenzaldehyde?

The XLogP3-AA value of 2,6-Difluoro-4-methoxybenzaldehyde is 1.6.

How many rotatable bond counts does 2,6-Difluoro-4-methoxybenzaldehyde have?

2,6-Difluoro-4-methoxybenzaldehyde has 2 rotatable bond counts.

What is the exact mass of 2,6-Difluoro-4-methoxybenzaldehyde?

The exact mass of 2,6-Difluoro-4-methoxybenzaldehyde is 172.03358575 g/mol.

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