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138800-85-8 | Aminylium, 1-pyrenyl-
CAS No: 138800-85-8 Catalog No: AG0019LV MDL No:
Product Description
Catalog Number:
AG0019LV
Chemical Name:
Aminylium, 1-pyrenyl-
CAS Number:
138800-85-8
Molecular Formula:
C16H10N+
Molecular Weight:
216.2573
InChI:
InChI=1S/C16H11N/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H,17H2/q+1
InChI Key:
UHFGPUFNXWDGBC-UHFFFAOYSA-N
SMILES:
[NH+]c1ccc2c3c1ccc1c3c(cc2)ccc1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.089g/mol
Formal Charge:
1
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.271g/mol
Monoisotopic Mass:
217.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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