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893739-01-0 | Benzenemethanol,4-(3-quinolinyl)-
CAS No: 893739-01-0 Catalog No: AG003WXN MDL No:
Product Description
Catalog Number:
AG003WXN
Chemical Name:
Benzenemethanol,4-(3-quinolinyl)-
CAS Number:
893739-01-0
Molecular Formula:
C15H14O3
Molecular Weight:
242.2699
IUPAC Name:
[4-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]methanol
InChI:
InChI=1S/C15H14O3/c16-10-11-1-3-12(4-2-11)13-5-6-14-15(9-13)18-8-7-17-14/h1-6,9,16H,7-8,10H2
InChI Key:
UNKQAGUNIXLHRM-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1)c1ccc2c(c1)OCCO2
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.094g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.274g/mol
Monoisotopic Mass:
242.094g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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