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Home > Pyridines > 651741-86-5
651741-86-5 | Pyridine, 4-[(1Z)-2-(1,3-benzodioxol-5-yl)ethenyl]-
CAS No: 651741-86-5 Catalog No: AG00H7RA MDL No:
Product Description
Catalog Number:
AG00H7RA
Chemical Name:
Pyridine, 4-[(1Z)-2-(1,3-benzodioxol-5-yl)ethenyl]-
CAS Number:
651741-86-5
Molecular Formula:
C14H11NO2
Molecular Weight:
225.2426
IUPAC Name:
4-[2-(1,3-benzodioxol-5-yl)ethenyl]pyridine
InChI:
InChI=1S/C14H11NO2/c1(11-5-7-15-8-6-11)2-12-3-4-13-14(9-12)17-10-16-13/h1-9H,10H2
InChI Key:
YOBLRHFAUWAOPW-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)/C=C\c1ccc2c(c1)OCO2
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.079g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.247g/mol
Monoisotopic Mass:
225.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.3
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