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87869-54-3 | 2-Propen-1-amine, N-[1-(3-methoxyphenyl)ethylidene]-, (E)-
CAS No: 87869-54-3 Catalog No: AG004G5H MDL No:
Product Description
Catalog Number:
AG004G5H
Chemical Name:
2-Propen-1-amine, N-[1-(3-methoxyphenyl)ethylidene]-, (E)-
CAS Number:
87869-54-3
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
IUPAC Name:
1-(3-methoxyphenyl)-N-prop-2-enylethanimine
InChI:
InChI=1S/C12H15NO/c1-4-8-13-10(2)11-6-5-7-12(9-11)14-3/h4-7,9H,1,8H2,2-3H3
InChI Key:
OPXHZAIKZJCYAJ-UHFFFAOYSA-N
SMILES:
C=CC/N=C(/c1cccc(c1)OC)\C
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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