4-(Difluoromethoxy)benzaldehyde

• CAS: 73960-07-3
• Catalog Number: ACM73960073
• Category: Other Products
• Molecular Weight: 172.13
• Molecular Formula: C₈H₆F₂O₂
• Synonyms: 4-(DIFLUOROMETHOXY)BENZALDEHYDE;AKOS B006820;AKOS BBS-00000693;TIMTEC-BB SBB003837;VITAS-BB TBB000651;p-(difluoromethoxy)benzaldehyde;4-(Difluoromethoxy)benzaldehyde 98%;4-(Difluoromethoxy)benzaldehyde98%
• Boiling Point: 222°C(lit.)
• Flash Point: 228°F
• Density: 1.302g/mL at 25°C(lit.)
• Hazard Statements: Xi
• Safety Description: 26-36/37/39-37/39
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 4-(Difluoromethoxy)benzaldehyde?

The molecular formula is C8H6F2O2.

When was 4-(Difluoromethoxy)benzaldehyde created in PubChem?

It was created on July 19, 2005.

What is the computed IUPAC name of 4-(Difluoromethoxy)benzaldehyde?

The computed IUPAC name is 4-(difluoromethoxy)benzaldehyde.

What is the InChIKey of 4-(Difluoromethoxy)benzaldehyde?

The InChIKey is ZWCXOJYJJINQGU-UHFFFAOYSA-N.

How many hydrogen bond acceptors are there in 4-(Difluoromethoxy)benzaldehyde?

There are 4 hydrogen bond acceptors.

What is the topological polar surface area of 4-(Difluoromethoxy)benzaldehyde?

The topological polar surface area is 26.3 Ų.

Is 4-(Difluoromethoxy)benzaldehyde a canonicalized compound?

Yes, it is a canonicalized compound.

What is the molar mass of 4-(Difluoromethoxy)benzaldehyde?

The molar mass is 172.13 g/mol.

How many rotatable bond counts are there in 4-(Difluoromethoxy)benzaldehyde?

There are 3 rotatable bond counts.

What is the complexity value of 4-(Difluoromethoxy)benzaldehyde?

The complexity value is 142.

Synthetic Use

Upstream Synthesis Route 1

• 75-45-6
• 123-08-0

• 73960-07-3

Reference: [1] Patent: US2008/306027, 2008, A1, . Location in patent: Page/Page column 7-8

Upstream Synthesis Route 2

• 1895-39-2
• 123-08-0

• 73960-07-3

Reference: [1] Patent: CN104059082, 2016, B, . Location in patent: Paragraph 0061; 0062

Upstream Synthesis Route 3

• 87199-17-5

• 73960-07-3

Reference: [1] Patent: WO2014/107380, 2014, A1, . Location in patent: Paragraph 00157-00162

Downstream Synthesis Route 1

• 141-82-2
• 73960-07-3

• 103962-07-8
• 127842-68-6

Reference: [1]Journal of Organic Chemistry USSR (English Translation),1989,vol. 25,p. 2134 - 2138
Zhurnal Organicheskoi Khimii,1989,vol. 25,p. 2367 - 2372

Downstream Synthesis Route 2

• 73960-07-3

• 75895-49-7

Reference: [1]Journal of Organic Chemistry USSR (English Translation),1980,vol. 16,p. 1272 - 1275
Zhurnal Organicheskoi Khimii,1980,vol. 16,p. 1479 - 1483

Downstream Synthesis Route 3

• 73960-07-3
• 141-97-9

• 84761-72-8

Reference: [1]Pharmaceutical Chemistry Journal,1982,vol. 16,p. 817 - 824
Khimiko-Farmatsevticheskii Zhurnal,1982,vol. 16,p. 1322 - 1329

* For details of the synthesis route, please refer to the original source to ensure accuracy.