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143936-77-0 | 3-Pyridinol, 2,6-bis(bromomethyl)-, hydrobromide (1:1)
CAS No: 143936-77-0 Catalog No: AG001IN4 MDL No:
Product Description
Catalog Number:
AG001IN4
Chemical Name:
3-Pyridinol, 2,6-bis(bromomethyl)-, hydrobromide (1:1)
CAS Number:
143936-77-0
Molecular Formula:
C7H8Br3NO
Molecular Weight:
361.8565
IUPAC Name:
2,6-bis(bromomethyl)pyridin-3-ol;hydrobromide
InChI:
InChI=1S/C7H7Br2NO.BrH/c8-3-5-1-2-7(11)6(4-9)10-5;/h1-2,11H,3-4H2;1H
InChI Key:
AQJBCXNVPRWZCT-UHFFFAOYSA-N
SMILES:
BrCc1ccc(c(n1)CBr)O.Br
Properties
Complexity:
123
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.814g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
361.859g/mol
Monoisotopic Mass:
358.816g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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