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19254-83-2 | Pyrene, 4,5,9,10-tetrahydro-2,7-dimethoxy-
CAS No: 19254-83-2 Catalog No: AG002G31 MDL No:
Product Description
Catalog Number:
AG002G31
Chemical Name:
Pyrene, 4,5,9,10-tetrahydro-2,7-dimethoxy-
CAS Number:
19254-83-2
Molecular Formula:
C18H18O2
Molecular Weight:
266.3343
IUPAC Name:
2,7-dimethoxy-4,5,9,10-tetrahydropyrene
InChI:
InChI=1S/C18H18O2/c1-19-15-7-11-3-5-13-9-16(20-2)10-14-6-4-12(8-15)17(11)18(13)14/h7-10H,3-6H2,1-2H3
InChI Key:
KRTHIZNLHVIDOU-UHFFFAOYSA-N
SMILES:
COc1cc2CCc3c4c2c(c1)CCc4cc(c3)OC
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.131g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.34g/mol
Monoisotopic Mass:
266.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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