4-Chlorobenzaldehyde dimethyl acetal

• CAS: 3395-81-1
• Catalog Number: ACM3395811
• Category: Ortho Esters
• Molecular Weight: 186.64
• Molecular Formula: C₉H₉BrO₂
• Synonyms: 3395-81-1, 4-Chlorobenzaldehyde dimethyl acetal, 1-chloro-4-(dimethoxymethyl)benzene, 1-CHLORO-4-DIMETHOXYMETHYL-BENZENE, ACMC-20amky, AC1LAUJY, Benzene, 4-chloro-1-(dimethoxymethyl)-, SureCN654510, 499110_ALDRICH, CTK4H1530, ZINC00403314, AKOS015964299, 1-chloro-4-(dimethoxy-methyl)-benzene, Benzene,1-chloro-4-(dimethoxymethyl)-, AK140362, KB-11936
• IUPAC Name: 1-chloro-4-(dimethoxymethyl)benzene
• Canonical SMILES: COC(C1=CC=C(C=C1)Cl)OC
• InChI Key: YRNBYTFFWMWTGG-UHFFFAOYSA-N
• Boiling Point: 114-115ºC19 mm Hg(lit.)
• Flash Point: 215 °F
• Density: 1.128 g/mL at 25ºC(lit.)
• Exact Mass: 186.04500
• Hazard Statements: H315-H319-H335
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Symbol: GHS07
• WGK Germany: 3

Custom Q&A

What is the PubChem CID for 4-Chlorobenzaldehyde dimethyl acetal?

The PubChem CID for 4-Chlorobenzaldehyde dimethyl acetal is 520661.

What is the molecular formula of 4-Chlorobenzaldehyde dimethyl acetal?

The molecular formula of 4-Chlorobenzaldehyde dimethyl acetal is C9H11ClO2.

What is the molecular weight of 4-Chlorobenzaldehyde dimethyl acetal?

The molecular weight of 4-Chlorobenzaldehyde dimethyl acetal is 186.63 g/mol.

What is the IUPAC name of 4-Chlorobenzaldehyde dimethyl acetal?

The IUPAC name of 4-Chlorobenzaldehyde dimethyl acetal is 1-chloro-4-(dimethoxymethyl)benzene.

What is the InChI of 4-Chlorobenzaldehyde dimethyl acetal?

The InChI of 4-Chlorobenzaldehyde dimethyl acetal is InChI=1S/C9H11ClO2/c1-11-9(12-2)7-3-5-8(10)6-4-7/h3-6,9H,1-2H3.

What is the InChIKey of 4-Chlorobenzaldehyde dimethyl acetal?

The InChIKey of 4-Chlorobenzaldehyde dimethyl acetal is YRNBYTFFWMWTGG-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Chlorobenzaldehyde dimethyl acetal?

The Canonical SMILES of 4-Chlorobenzaldehyde dimethyl acetal is COC(C1=CC=C(C=C1)Cl)OC.

What is the CAS number of 4-Chlorobenzaldehyde dimethyl acetal?

The CAS number of 4-Chlorobenzaldehyde dimethyl acetal is 3395-81-1.

What is the XLogP3-AA value of 4-Chlorobenzaldehyde dimethyl acetal?

The XLogP3-AA value of 4-Chlorobenzaldehyde dimethyl acetal is 2.2.

Is 4-Chlorobenzaldehyde dimethyl acetal a canonicalized compound?

Yes, 4-Chlorobenzaldehyde dimethyl acetal is a canonicalized compound.