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197722-88-6 | 1-Pyreneethanamine
CAS No: 197722-88-6 Catalog No: AG002AZQ MDL No:
Product Description
Catalog Number:
AG002AZQ
Chemical Name:
1-Pyreneethanamine
CAS Number:
197722-88-6
Molecular Formula:
C18H15N
Molecular Weight:
245.3184
IUPAC Name:
2-pyren-1-ylethanamine
InChI:
InChI=1S/C18H15N/c19-11-10-12-4-5-15-7-6-13-2-1-3-14-8-9-16(12)18(15)17(13)14/h1-9H,10-11,19H2
InChI Key:
WUMDHWAMJFRWNL-UHFFFAOYSA-N
SMILES:
NCCc1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.12g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.325g/mol
Monoisotopic Mass:
245.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Literature
| Title | Journal |
|---|---|
| Fluorescent reporters of monoamine transporter distribution and function. | Bioorganic & medicinal chemistry letters 20111215 |
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