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79687-96-0 | 5,6-Acenaphthylenediamine, 1,2-dihydro-N,N,N'-trimethyl-
CAS No: 79687-96-0 Catalog No: AG005IMZ MDL No:
Product Description
Catalog Number:
AG005IMZ
Chemical Name:
5,6-Acenaphthylenediamine, 1,2-dihydro-N,N,N'-trimethyl-
CAS Number:
79687-96-0
Molecular Formula:
C15H18N2
Molecular Weight:
226.3168
IUPAC Name:
5-N,5-N,6-N-trimethyl-1,2-dihydroacenaphthylene-5,6-diamine
InChI:
InChI=1S/C15H18N2/c1-16-12-8-6-10-4-5-11-7-9-13(17(2)3)15(12)14(10)11/h6-9,16H,4-5H2,1-3H3
InChI Key:
MJZMKHVVSNNPEE-UHFFFAOYSA-N
SMILES:
CNc1ccc2c3c1c(ccc3CC2)N(C)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.323g/mol
Monoisotopic Mass:
226.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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