2-Chloro-1,10-Phenanthroline

• CAS: 7089-68-1
• Catalog Number: ACM7089681-2
• Category: Other
• Molecular Weight: 214.65
• Molecular Formula: C12H7ClN2
• Synonyms: 1,10-Phenanthroline, 2-chloro-
• IUPAC Name: 2-chloro-1,10-phenanthroline
• Canonical SMILES: C1=CC2=C(C3=C(C=C2)C=CC(=N3)Cl)N=C1
• InChI: InChI=1S/C12H7ClN2/c13-10-6-5-9-4-3-8-2-1-7-14-11(8)12(9)15-10/h1-7H
• InChI Key: JHRMQHFRVPVGHL-UHFFFAOYSA-N
• Boiling Point: 391.8±22.0 ºC
• Melting Point: 130 ºC
• Density: 1.375 g/ml
• Solubility: >32.2 [ug/mL]
• Appearance: White to yellow to orange powder to crystal
• Storage: Store under inert gas
• Complexity: 234
• Covalently-Bonded Unit Count: 1
• Exact Mass: 214.0297759
• H-Bond Acceptor: 2
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 0
• MDL Number: MFCD00185678
• Monoisotopic Mass: 214.0297759
• Precautionary Statements: P262
• Rotatable Bond Count: 0
• Topological Polar Surface Area: 25.8 Ų

Custom Q&A

What is the molecular formula of 2-Chloro-1,10-phenanthroline?

The molecular formula of 2-Chloro-1,10-phenanthroline is C12H7ClN2.

What is the molecular weight of 2-Chloro-1,10-phenanthroline?

The molecular weight of 2-Chloro-1,10-phenanthroline is 214.65 g/mol.

What is the IUPAC name of 2-Chloro-1,10-phenanthroline?

The IUPAC name of 2-Chloro-1,10-phenanthroline is 2-chloro-1,10-phenanthroline.

What is the InChI of 2-Chloro-1,10-phenanthroline?

The InChI of 2-Chloro-1,10-phenanthroline is InChI=1S/C12H7ClN2/c13-10-6-5-9-4-3-8-2-1-7-14-11(8)12(9)15-10/h1-7H.

What is the InChIKey of 2-Chloro-1,10-phenanthroline?

The InChIKey of 2-Chloro-1,10-phenanthroline is JHRMQHFRVPVGHL-UHFFFAOYSA-N.

What is the canonical SMILES representation of 2-Chloro-1,10-phenanthroline?

The canonical SMILES representation of 2-Chloro-1,10-phenanthroline is C1=CC2=C(C3=C(C=C2)C=CC(=N3)Cl)N=C1.

What is the Common Chemistry CAS number for 2-Chloro-1,10-phenanthroline?

The Common Chemistry CAS number for 2-Chloro-1,10-phenanthroline is 7089-68-1.

What is the XLogP3 value of 2-Chloro-1,10-phenanthroline?

The XLogP3 value of 2-Chloro-1,10-phenanthroline is 2.7.

How many hydrogen bond acceptors does 2-Chloro-1,10-phenanthroline have?

2-Chloro-1,10-phenanthroline has 2 hydrogen bond acceptors.

Is 2-Chloro-1,10-phenanthroline a canonicalized compound?

Yes, 2-Chloro-1,10-phenanthroline is a canonicalized compound.