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144735-54-6 | Benzene, 4-ethynyl-2-methoxy-1-(phenylmethoxy)-
CAS No: 144735-54-6 Catalog No: AG001K2B MDL No:
Product Description
Catalog Number:
AG001K2B
Chemical Name:
Benzene, 4-ethynyl-2-methoxy-1-(phenylmethoxy)-
CAS Number:
144735-54-6
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
IUPAC Name:
4-ethynyl-2-methoxy-1-phenylmethoxybenzene
InChI:
InChI=1S/C16H14O2/c1-3-13-9-10-15(16(11-13)17-2)18-12-14-7-5-4-6-8-14/h1,4-11H,12H2,2H3
InChI Key:
PLUHQGRVJMSIDW-UHFFFAOYSA-N
SMILES:
COc1cc(C#C)ccc1OCc1ccccc1
Properties
Complexity:
285
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.099g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.286g/mol
Monoisotopic Mass:
238.099g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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