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Home > Pyridines > 1600480-92-9
1600480-92-9 | ethyl 3-(2-methylpyridin-4-yl)prop-2-ynoate
CAS No: 1600480-92-9 Catalog No: AG01DRDO MDL No:MFCD31463514
Product Description
Catalog Number:
AG01DRDO
Chemical Name:
ethyl 3-(2-methylpyridin-4-yl)prop-2-ynoate
CAS Number:
1600480-92-9
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD31463514
IUPAC Name:
ethyl 3-(2-methylpyridin-4-yl)prop-2-ynoate
InChI:
InChI=1S/C11H11NO2/c1-3-14-11(13)5-4-10-6-7-12-9(2)8-10/h6-8H,3H2,1-2H3
InChI Key:
PELBUAGFCHPBST-UHFFFAOYSA-N
SMILES:
CCOC(=O)C#Cc1ccnc(c1)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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