1-Pyrenemethanol

• CAS: 24463-15-8
• Catalog Number: ACM24463158
• Category: Other Products
• Molecular Weight: 232.28
• Molecular Formula: C17H12O
• Synonyms: 1-Hydroxymethylpyrene
• IUPAC Name: pyren-1-ylmethanol
• Canonical SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CO
• InChI: InChI=1S/C17H12O/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-9,18H,10H2
• InChI Key: NGDMLQSGYUCLDC-UHFFFAOYSA-N
• Boiling Point: 455.2°C
• Appearance: Crystalline
• Complexity: 313
• Covalently-Bonded Unit Count: 1
• Exact Mass: 232.088815g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• Heavy Atom Count: 18
• Monoisotopic Mass: 232.088815g/mol
• Refractive Index: 1.855
• Rotatable Bond Count: 1
• UNII: C76UX3EH8M
• XLogP3: 4.2