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87102-11-2 | methyl 2-[hydroxy(pyridin-3-yl)methyl]acrylate
CAS No: 87102-11-2 Catalog No: AG00JK34 MDL No:MFCD09961878
Product Description
Catalog Number:
AG00JK34
Chemical Name:
methyl 2-[hydroxy(pyridin-3-yl)methyl]acrylate
CAS Number:
87102-11-2
Molecular Formula:
C10H11NO3
Molecular Weight:
193.1992
MDL Number:
MFCD09961878
IUPAC Name:
methyl 2-[hydroxy(pyridin-3-yl)methyl]prop-2-enoate
InChI:
InChI=1S/C10H11NO3/c1-7(10(13)14-2)9(12)8-4-3-5-11-6-8/h3-6,9,12H,1H2,2H3
InChI Key:
SVGCYNLCSWXUTM-UHFFFAOYSA-N
SMILES:
COC(=O)C(=C)C(c1cccnc1)O
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.074g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
193.202g/mol
Monoisotopic Mass:
193.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Literature
| Title | Journal |
|---|---|
| High selective leishmanicidal activity of 3-hydroxy-2-methylene-3-(4-bromophenyl)propanenitrile and analogous compounds. | European journal of medicinal chemistry 20070101 |
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