4-Fluorobenzaldehyde

• Catalog Number: ACM459574
• Product Name: 4-Fluorobenzaldehyde
• CAS: 459-57-4
• Category: Heterocyclic Organic Compound
• IUPAC Name: 4-fluorobenzaldehyde
• Molecular Weight: 124.11
• Molecular Formula: C7H5FO
• Canonical SMILES: C1=CC(=CC=C1C=O)F
• InChI: InChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H
• InChI Key: UOQXIWFBQSVDPP-UHFFFAOYSA-N
• Boiling Point: 181 °C
• Melting Point: -10.0 °C
• Density: Air Sensitive
• Appearance: Colorless to Light orange to Yellow clear liquid
• Storage: Store under inert gas
• Complexity: 95.1
• Covalently-Bonded Unit Count: 1
• EC Number: 207-293-6
• Exact Mass: 124.032443g/mol
• Formal Charge: 0
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.H226 : Flammable liquid and vapor.
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• Heavy Atom Count: 9
• LogP: 1.54 (LogP)
• MDL Number: MFCD00003378
• Monoisotopic Mass: 124.032443g/mol
• NSC Number: 68095
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P240 : Ground/bond container and receiving equipment.P210 : Keep away from heat/sparks/open flames/hot surfaces. No smoking.P233 : Keep container tightly closed.P243 : Take precautionary measures against static discharge.P241 : Use explosion-proof electrical/ ventilating/ lighting/ equipment.P242 : Use only non-sparking tools.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P370 + P378 : In case of fire: Use dry sand, dry chemical or alcohol-resistant foam to extinguish.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P303 + P361 + P353 : IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.P403 + P235 : Store in a well-ventilated place. Keep cool.
• Refractive Index: 1.52
• RIDADR: UN 2735PSN1 8 / PGIII
• Rotatable Bond Count: 1
• Signal Word: Warning
• SpecificGravity: 1.18
• Symbol: GHS07
• UNII: N8681893GA
• XLogP3: 1.6

Custom Q&A

What is the molecular formula of 4-Fluorobenzaldehyde?

The molecular formula of 4-Fluorobenzaldehyde is C7H5FO.

What is the molecular weight of 4-Fluorobenzaldehyde?

The molecular weight of 4-Fluorobenzaldehyde is 124.11 g/mol.

What is the IUPAC name of 4-Fluorobenzaldehyde?

The IUPAC name of 4-Fluorobenzaldehyde is 4-fluorobenzaldehyde.

What is the InChI of 4-Fluorobenzaldehyde?

The InChI of 4-Fluorobenzaldehyde is InChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H.

What is the InChIKey of 4-Fluorobenzaldehyde?

The InChIKey of 4-Fluorobenzaldehyde is UOQXIWFBQSVDPP-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Fluorobenzaldehyde?

The canonical SMILES of 4-Fluorobenzaldehyde is C1=CC(=CC=C1C=O)F.

What is the CAS number of 4-Fluorobenzaldehyde?

The CAS number of 4-Fluorobenzaldehyde is 459-57-4.

What is the XLogP3 value of 4-Fluorobenzaldehyde?

The XLogP3 value of 4-Fluorobenzaldehyde is 1.6.

How many hydrogen bond donor counts are there in 4-Fluorobenzaldehyde?

There are no hydrogen bond donor counts in 4-Fluorobenzaldehyde.

How many hydrogen bond acceptor counts are there in 4-Fluorobenzaldehyde?

There are two hydrogen bond acceptor counts in 4-Fluorobenzaldehyde.