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17938-84-0 | Anthracene, 9-(2-propyn-1-yl)-
CAS No: 17938-84-0 Catalog No: AG0026Z0 MDL No:
Product Description
Catalog Number:
AG0026Z0
Chemical Name:
Anthracene, 9-(2-propyn-1-yl)-
CAS Number:
17938-84-0
Molecular Formula:
C17H12
Molecular Weight:
216.2772
IUPAC Name:
9-prop-2-ynylanthracene
InChI:
InChI=1S/C17H12/c1-2-7-17-15-10-5-3-8-13(15)12-14-9-4-6-11-16(14)17/h1,3-6,8-12H,7H2
InChI Key:
XKDSXAVXIPNQLH-UHFFFAOYSA-N
SMILES:
C#CCc1c2ccccc2cc2c1cccc2
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.094g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.283g/mol
Monoisotopic Mass:
216.094g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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