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82244-22-2 | 3-(2-Pyridinyl)-2-buten-1-ol
CAS No: 82244-22-2 Catalog No: AG01EXJP MDL No:MFCD18384623
Product Description
Catalog Number:
AG01EXJP
Chemical Name:
3-(2-Pyridinyl)-2-buten-1-ol
CAS Number:
82244-22-2
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD18384623
IUPAC Name:
(E)-3-pyridin-2-ylbut-2-en-1-ol
InChI:
InChI=1S/C9H11NO/c1-8(5-7-11)9-4-2-3-6-10-9/h2-6,11H,7H2,1H3/b8-5+
InChI Key:
QFIHEWJDVCNBIO-VMPITWQZSA-N
SMILES:
OC/C=C(/c1ccccn1)\C
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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