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704-20-1 | Pyridine, 2-(2,4-cyclopentadien-1-ylidene)-1,2-dihydro-1-methyl-
CAS No: 704-20-1 Catalog No: AG005IYI MDL No:
Product Description
Catalog Number:
AG005IYI
Chemical Name:
Pyridine, 2-(2,4-cyclopentadien-1-ylidene)-1,2-dihydro-1-methyl-
CAS Number:
704-20-1
Molecular Formula:
C11H11N
Molecular Weight:
157.2117
IUPAC Name:
2-cyclopenta-2,4-dien-1-ylidene-1-methylpyridine
InChI:
InChI=1S/C11H11N/c1-12-9-5-4-8-11(12)10-6-2-3-7-10/h2-9H,1H3
InChI Key:
BSPGRFYHUVQMPJ-UHFFFAOYSA-N
SMILES:
Cn1ccccc1=C1C=CC=C1
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
157.216g/mol
Monoisotopic Mass:
157.089g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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