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Home > Other Heterocycles > 94632-73-2
94632-73-2 | 2,7-dimethoxybicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
CAS No: 94632-73-2 Catalog No: AG00H5QF MDL No:
Product Description
Catalog Number:
AG00H5QF
Chemical Name:
2,7-dimethoxybicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
CAS Number:
94632-73-2
Molecular Formula:
C13H14O2
Molecular Weight:
202.2491
IUPAC Name:
2,7-dimethoxybicyclo[4.4.1]undeca-1,3,5,7,9-pentaene
InChI:
InChI=1S/C13H14O2/c1-14-12-7-3-6-11-9-10(12)5-4-8-13(11)15-2/h3-8H,9H2,1-2H3
InChI Key:
CCJHTIMTDUTUEE-UHFFFAOYSA-N
SMILES:
COc1cccc2Cc1cccc2OC
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.099g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.253g/mol
Monoisotopic Mass:
202.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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