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1186405-22-0 | (E)-Methyl 3-(3-methyl-3H-imidazo[4,5-b]pyridin-6-yl)acrylate
CAS No: 1186405-22-0 Catalog No: AG00HEOE MDL No:MFCD12922817
Product Description
Catalog Number:
AG00HEOE
Chemical Name:
(E)-Methyl 3-(3-methyl-3H-imidazo[4,5-b]pyridin-6-yl)acrylate
CAS Number:
1186405-22-0
Molecular Formula:
C11H11N3O2
Molecular Weight:
217.2239
MDL Number:
MFCD12922817
IUPAC Name:
methyl (E)-3-(3-methylimidazo[4,5-b]pyridin-6-yl)prop-2-enoate
InChI:
InChI=1S/C11H11N3O2/c1-14-7-13-9-5-8(6-12-11(9)14)3-4-10(15)16-2/h3-7H,1-2H3/b4-3+
InChI Key:
VPWQXRIXCZJGBK-ONEGZZNKSA-N
SMILES:
COC(=O)/C=C/c1cnc2c(c1)ncn2C
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
217.085g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.228g/mol
Monoisotopic Mass:
217.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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