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20404-87-9 | Pyridinium, 1-methyl-4-[2-(1-naphthalenyl)ethenyl]-, iodide (1:1)
CAS No: 20404-87-9 Catalog No: AG00299W MDL No:
Product Description
Catalog Number:
AG00299W
Chemical Name:
Pyridinium, 1-methyl-4-[2-(1-naphthalenyl)ethenyl]-, iodide (1:1)
CAS Number:
20404-87-9
Molecular Formula:
C18H16IN
Molecular Weight:
373.2308
IUPAC Name:
1-methyl-4-(2-naphthalen-1-ylethenyl)pyridin-1-ium;iodide
InChI:
InChI=1S/C18H16N.HI/c1-19-13-11-15(12-14-19)9-10-17-7-4-6-16-5-2-3-8-18(16)17;/h2-14H,1H3;1H/q+1;/p-1
InChI Key:
JWXOJSQIAOTKFF-UHFFFAOYSA-M
SMILES:
C[n+]1ccc(cc1)C=Cc1cccc2c1cccc2.[I-]
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
373.033g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
373.237g/mol
Monoisotopic Mass:
373.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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