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101330-11-4 | 3-Quinolinemethanol, 2-iodo-
CAS No: 101330-11-4 Catalog No: AG00049I MDL No:
Product Description
Catalog Number:
AG00049I
Chemical Name:
3-Quinolinemethanol, 2-iodo-
CAS Number:
101330-11-4
Molecular Formula:
C10H8INO
Molecular Weight:
285.0811
IUPAC Name:
(2-iodoquinolin-3-yl)methanol
InChI:
InChI=1S/C10H8INO/c11-10-8(6-13)5-7-3-1-2-4-9(7)12-10/h1-5,13H,6H2
InChI Key:
VUWYEQNEXNDCCO-UHFFFAOYSA-N
SMILES:
OCc1cc2ccccc2nc1I
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.965g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
285.084g/mol
Monoisotopic Mass:
284.965g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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