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144661-26-7 | Benzenamine, N-[1-(2-phenylethenyl)-3-buten-1-yl]-
CAS No: 144661-26-7 Catalog No: AG001JY0 MDL No:
Product Description
Catalog Number:
AG001JY0
Chemical Name:
Benzenamine, N-[1-(2-phenylethenyl)-3-buten-1-yl]-
CAS Number:
144661-26-7
Molecular Formula:
C18H19N
Molecular Weight:
249.3502
IUPAC Name:
N-(1-phenylhexa-1,5-dien-3-yl)aniline
InChI:
InChI=1S/C18H19N/c1-2-9-17(19-18-12-7-4-8-13-18)15-14-16-10-5-3-6-11-16/h2-8,10-15,17,19H,1,9H2
InChI Key:
JSRIGJPIVTXRGL-UHFFFAOYSA-N
SMILES:
C=CCC(Nc1ccccc1)C=Cc1ccccc1
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.357g/mol
Monoisotopic Mass:
249.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
5.2
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