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277-98-5 | Cyclobuta[b]naphthalene
CAS No: 277-98-5 Catalog No: AG002UIL MDL No:
Product Description
Catalog Number:
AG002UIL
Chemical Name:
Cyclobuta[b]naphthalene
CAS Number:
277-98-5
Molecular Formula:
C12H8
Molecular Weight:
152.1919
IUPAC Name:
cyclobuta[b]naphthalene
InChI:
InChI=1S/C12H8/c1-2-4-10-8-12-6-5-11(12)7-9(10)3-1/h1-8H
InChI Key:
XHOJCDAJMHQBTM-UHFFFAOYSA-N
SMILES:
c1ccc2c(c1)cc1c(c2)C=C1
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.063g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.196g/mol
Monoisotopic Mass:
152.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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