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236-81-7 | 1,4-Epoxynaphthalene
CAS No: 236-81-7 Catalog No: AG002NV9 MDL No:
Product Description
Catalog Number:
AG002NV9
Chemical Name:
1,4-Epoxynaphthalene
CAS Number:
236-81-7
Molecular Formula:
C10H6O
Molecular Weight:
142.1540
IUPAC Name:
11-oxatricyclo[6.2.1.02,7]undeca-1(10),2,4,6,8-pentaene
InChI:
InChI=1S/C10H6O/c1-2-4-8-7(3-1)9-5-6-10(8)11-9/h1-6H
InChI Key:
ZKPRFGFRFQXTIU-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)c1ccc2o1
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.042g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.157g/mol
Monoisotopic Mass:
142.042g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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