4-Carboxybutyl triphenylphosphonium bromide

• CAS: 17814-85-6
• Catalog Number: ACM17814856-2
• Category: Bromine Series
• Molecular Weight: 443.32
• Molecular Formula: C23H24O2PBr
• Synonyms: 5-(Triphenylphosphonio)pentanoic acid bromide; Carboxybutyltriphenylphosphonium bromide
• IUPAC Name: 4-carboxybutyl(triphenyl)phosphanium;bromide
• Canonical SMILES: C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
• InChI: MLOSJPZSZWUDSK-UHFFFAOYSA-N
• InChI Key: InChI=1S/C23H23O2P.BrH/c24-23(25)18-10-11-19-26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-9,12-17H,10-11,18-19H2;1H
• Melting Point: 204-207 °C(lit.)
• Flash Point: 383 °F
• Appearance: Solid
• Application: suzuki reaction
• Storage: Refrigerator
• Complexity: 372
• Covalently-Bonded Unit Count: 2
• EC Number: 241-782-5
• Exact Mass: 442.07g/mol
• H-Bond Acceptor: 3
• H-Bond Donor: 1
• Heavy Atom Count: 27
• Isomeric SMILES: C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
• Monoisotopic Mass: 442.07g/mol
• NSC Number: 147756
• Rotatable Bond Count: 8
• Topological Polar Surface Area: 37.3A^2

Custom Q&A

What is the CAS number for 4-Carboxybutyl triphenylphosphonium bromide?

17814-85-6

What is the molecular formula of 4-Carboxybutyl triphenylphosphonium bromide?

C23H24BrO2P

What is the exact mass of 4-Carboxybutyl triphenylphosphonium bromide?

442.06973

What is the IUPAC name of 4-Carboxybutyl triphenylphosphonium bromide?

4-carboxybutyl(triphenyl)phosphanium;bromide

How many hydrogen bond acceptor counts does 4-Carboxybutyl triphenylphosphonium bromide have?

3

What is the canonical SMILES representation of 4-Carboxybutyl triphenylphosphonium bromide?

C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

How many heavy atom count does 4-Carboxybutyl triphenylphosphonium bromide have?

27

What is the molecular weight of 4-Carboxybutyl triphenylphosphonium bromide?

443.3g/mol

What is the Monoisotopic mass of 4-Carboxybutyl triphenylphosphonium bromide?

442.06973

What is the alternative name for 4-Carboxybutyl triphenylphosphonium bromide starting with "Phosphonium"?

Phosphonium, (4-carboxybutyl)triphenyl-, bromide