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263714-29-0 | 2(1H)-Naphthalenone, 3,4-dihydro-7-methoxy-1-(phenylmethyl)-
CAS No: 263714-29-0 Catalog No: AG002SX4 MDL No:
Product Description
Catalog Number:
AG002SX4
Chemical Name:
2(1H)-Naphthalenone, 3,4-dihydro-7-methoxy-1-(phenylmethyl)-
CAS Number:
263714-29-0
Molecular Formula:
C18H18O2
Molecular Weight:
266.3343
IUPAC Name:
1-benzyl-7-methoxy-3,4-dihydro-1H-naphthalen-2-one
InChI:
InChI=1S/C18H18O2/c1-20-15-9-7-14-8-10-18(19)17(16(14)12-15)11-13-5-3-2-4-6-13/h2-7,9,12,17H,8,10-11H2,1H3
InChI Key:
SBPRZKDJWZOZNO-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)C(Cc1ccccc1)C(=O)CC2
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.34g/mol
Monoisotopic Mass:
266.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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