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204450-51-1 | Methanone, [(2R,3S)-3-(1-naphthalenyl)-2-oxiranyl]phenyl-
CAS No: 204450-51-1 Catalog No: AG0029HZ MDL No:
Product Description
Catalog Number:
AG0029HZ
Chemical Name:
Methanone, [(2R,3S)-3-(1-naphthalenyl)-2-oxiranyl]phenyl-
CAS Number:
204450-51-1
Molecular Formula:
C19H14O2
Molecular Weight:
274.3133
IUPAC Name:
[(2R,3S)-3-naphthalen-1-yloxiran-2-yl]-phenylmethanone
InChI:
InChI=1S/C19H14O2/c20-17(14-8-2-1-3-9-14)19-18(21-19)16-12-6-10-13-7-4-5-11-15(13)16/h1-12,18-19H/t18-,19-/m0/s1
InChI Key:
JCEIOPSDKPXYSH-OALUTQOASA-N
SMILES:
O=C([C@@H]1O[C@H]1c1cccc2c1cccc2)c1ccccc1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
274.099g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.319g/mol
Monoisotopic Mass:
274.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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