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331711-99-0 | Naphthalene-1,8-diyl dibenzoate
CAS No: 331711-99-0 Catalog No: AG003DS8 MDL No:MFCD01001009
Product Description
Catalog Number:
AG003DS8
Chemical Name:
Naphthalene-1,8-diyl dibenzoate
CAS Number:
331711-99-0
Molecular Formula:
C24H16O4
Molecular Weight:
368.3814
MDL Number:
MFCD01001009
IUPAC Name:
(8-benzoyloxynaphthalen-1-yl) benzoate
InChI:
InChI=1S/C24H16O4/c25-23(18-9-3-1-4-10-18)27-20-15-7-13-17-14-8-16-21(22(17)20)28-24(26)19-11-5-2-6-12-19/h1-16H
InChI Key:
DFCIKCMSXYOIQD-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Oc1cccc2c1c(ccc2)OC(=O)c1ccccc1
EC Number:
810-797-4
Properties
Complexity:
487
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
368.105g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
368.388g/mol
Monoisotopic Mass:
368.105g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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