Name: Name:2-Propenoic acid, 3-(1-oxido-2-pyridinyl)-, ethyl ester, (2E)-
Brand: Angene
SKU: AG002R87
Rating: 90 (10 reviews)

2-Propenoic acid, 3-(1-oxido-2-pyridinyl)-, ethyl ester, (2E)-

CAS No.:

259729-55-0

Catalog Number:

AG002R87

Molecular Formula:

C10H11NO3

Molecular Weight:

193.1992

Catalog Number:

AG002R87

Chemical Name:

2-Propenoic acid, 3-(1-oxido-2-pyridinyl)-, ethyl ester, (2E)-

CAS Number:

259729-55-0

Molecular Formula:

C10H11NO3

Molecular Weight:

193.1992

MDL Number:

MFCD00957185

IUPAC Name:

ethyl (E)-3-(1-oxidopyridin-1-ium-2-yl)prop-2-enoate

InChI:

InChI=1S/C10H11NO3/c1-2-14-10(12)7-6-9-5-3-4-8-11(9)13/h3-8H,2H2,1H3/b7-6+

InChI Key:

UNFGPZXTXRKHKH-VOTSOKGWSA-N

SMILES:

CCOC(=O)/C=C/c1cccc[n+]1[O-]

Complexity:

215

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.202g/mol

Monoisotopic Mass:

193.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

51.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5