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14923-84-3 | 1,6-Pyrenediamine
CAS No: 14923-84-3 Catalog No: AG001LHF MDL No:MFCD00142568
Product Description
Catalog Number:
AG001LHF
Chemical Name:
1,6-Pyrenediamine
CAS Number:
14923-84-3
Molecular Formula:
C16H12N2
Molecular Weight:
232.2799
MDL Number:
MFCD00142568
IUPAC Name:
pyrene-1,6-diamine
InChI:
InChI=1S/C16H12N2/c17-13-8-4-10-2-6-12-14(18)7-3-9-1-5-11(13)16(10)15(9)12/h1-8H,17-18H2
InChI Key:
OWJJRQSAIMYXQJ-UHFFFAOYSA-N
SMILES:
Nc1ccc2c3c1ccc1c3c(cc2)c(cc1)N
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
232.286g/mol
Monoisotopic Mass:
232.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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