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1227599-26-9 | 2-Pyridinemethanol, 3-bromo-5-chloro-
CAS No: 1227599-26-9 Catalog No: AG000JE1 MDL No:MFCD16606988
Product Description
Catalog Number:
AG000JE1
Chemical Name:
2-Pyridinemethanol, 3-bromo-5-chloro-
CAS Number:
1227599-26-9
Molecular Formula:
C6H5BrClNO
Molecular Weight:
222.4670
MDL Number:
MFCD16606988
IUPAC Name:
(3-bromo-5-chloropyridin-2-yl)methanol
InChI:
InChI=1S/C6H5BrClNO/c7-5-1-4(8)2-9-6(5)3-10/h1-2,10H,3H2
InChI Key:
RPAYTSWGANTCGM-UHFFFAOYSA-N
SMILES:
OCc1ncc(cc1Br)Cl
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.924g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.466g/mol
Monoisotopic Mass:
220.924g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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