9-ethyl-9H-carbazol-3-amine hydrochloride

• ChemBase ID: 109807
• Molecular Formular: C14H15ClN2
• Molecular Mass: 246.7353
• Monoisotopic Mass: 246.09237617
• SMILES: Cl.CCn1c2ccc(N)cc2c2c1cccc2
• Canonical SMILES: CCn1c2ccc(cc2c2c1cccc2)N.Cl
• InChI: InChI=1S/C14H14N2.ClH/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16;/h3-9H,2,15H2,1H3;1H
• InChIKey: UUYSTZWIFZYHRM-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 9-ethyl-9H-carbazol-3-amine hydrochloride
• IUPAC Traditional name: 3-amino-9-ethylcarbazole hydrochloride
• Synonyms: 3-AMINO-9-ETHYLCARBAZOLE HYDROCHLORIDE

Database IDs

• CAS Number: 6109-97-3
• PubChem SID: 162088947
• PubChem CID: 62130

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): 2.8384743
• LogD (pH = 7.4): 2.8423936
• Log P: 2.8424437
• Molar Refractivity: 67.8179 cm^3
• Polarizability: 27.988945 Å^3
• Polar Surface Area: 30.95 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05212647

MP Biomedicals Rare Chemical collection