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138764-54-2 | Sodium, [9-(4-cyanophenyl)-9,10-dihydro-9-anthracenyl]-
CAS No: 138764-54-2 Catalog No: AG0019IE MDL No:
Product Description
Catalog Number:
AG0019IE
Chemical Name:
Sodium, [9-(4-cyanophenyl)-9,10-dihydro-9-anthracenyl]-
CAS Number:
138764-54-2
Molecular Formula:
C21H14NNa
Molecular Weight:
303.3323
IUPAC Name:
sodium;4-(10H-anthracen-9-id-9-yl)benzonitrile
InChI:
InChI=1S/C21H14N.Na/c22-14-15-9-11-16(12-10-15)21-19-7-3-1-5-17(19)13-18-6-2-4-8-20(18)21;/h1-12H,13H2;/q-1;+1
InChI Key:
WSYXKOWRIBJEEP-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)C1([Na])c2ccccc2Cc2c1cccc2
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.102g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
303.34g/mol
Monoisotopic Mass:
303.102g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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