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123063-36-5 | 1,2-Benzenediol, 4-undecyl-
CAS No: 123063-36-5 Catalog No: AG000K09 MDL No:
Product Description
Catalog Number:
AG000K09
Chemical Name:
1,2-Benzenediol, 4-undecyl-
CAS Number:
123063-36-5
Molecular Formula:
C17H28O2
Molecular Weight:
264.4030
IUPAC Name:
4-undecylbenzene-1,2-diol
InChI:
InChI=1S/C17H28O2/c1-2-3-4-5-6-7-8-9-10-11-15-12-13-16(18)17(19)14-15/h12-14,18-19H,2-11H2,1H3
InChI Key:
DJCPRTRHSKKEKX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCc1ccc(c(c1)O)O
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.209g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.409g/mol
Monoisotopic Mass:
264.209g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.8
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