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869885-81-4 | Benzene, 1-ethenyl-3-[(3-methylphenoxy)methyl]-
CAS No: 869885-81-4 Catalog No: AG004NWX MDL No:
Product Description
Catalog Number:
AG004NWX
Chemical Name:
Benzene, 1-ethenyl-3-[(3-methylphenoxy)methyl]-
CAS Number:
869885-81-4
Molecular Formula:
C16H16O
Molecular Weight:
224.2976
IUPAC Name:
1-ethenyl-3-[(3-methylphenoxy)methyl]benzene
InChI:
InChI=1S/C16H16O/c1-3-14-7-5-8-15(11-14)12-17-16-9-4-6-13(2)10-16/h3-11H,1,12H2,2H3
InChI Key:
OFKZDYVMACGADX-UHFFFAOYSA-N
SMILES:
C=Cc1cccc(c1)COc1cccc(c1)C
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.303g/mol
Monoisotopic Mass:
224.12g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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