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131357-85-2

131357-85-2 | 2,9,10-Anthracenetricarbonitrile

CAS No: 131357-85-2 Catalog No: AG000VZX MDL No:

Product Description

Catalog Number:
AG000VZX
Chemical Name:
2,9,10-Anthracenetricarbonitrile
CAS Number:
131357-85-2
Molecular Formula:
C17H7N3
Molecular Weight:
253.2576
IUPAC Name:
anthracene-2,9,10-tricarbonitrile
InChI:
InChI=1S/C17H7N3/c18-8-11-5-6-14-15(7-11)17(10-20)13-4-2-1-3-12(13)16(14)9-19/h1-7H
InChI Key:
JGWSCBKUFCAADX-UHFFFAOYSA-N
SMILES:
N#Cc1c2cc(C#N)ccc2c(c2c1cccc2)C#N

Properties

Complexity:
524  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.064g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.264g/mol
Monoisotopic Mass:
253.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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