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101891-90-1 | Naphthalene, 2,6-dibutoxy-
CAS No: 101891-90-1 Catalog No: AG0005UI MDL No:
Product Description
Catalog Number:
AG0005UI
Chemical Name:
Naphthalene, 2,6-dibutoxy-
CAS Number:
101891-90-1
Molecular Formula:
C18H24O2
Molecular Weight:
272.3820
IUPAC Name:
2,6-dibutoxynaphthalene
InChI:
InChI=1S/C18H24O2/c1-3-5-11-19-17-9-7-16-14-18(20-12-6-4-2)10-8-15(16)13-17/h7-10,13-14H,3-6,11-12H2,1-2H3
InChI Key:
RKDOUCYBKSQOTF-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc2c(c1)ccc(c2)OCCCC
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.178g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.388g/mol
Monoisotopic Mass:
272.178g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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