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4385-73-3 | 3-PYRIDIN-3-YL-BENZOIC ACID ETHYL ESTER
CAS No: 4385-73-3 Catalog No: AG00DZLO MDL No:MFCD11501319
Product Description
Catalog Number:
AG00DZLO
Chemical Name:
3-PYRIDIN-3-YL-BENZOIC ACID ETHYL ESTER
CAS Number:
4385-73-3
MDL Number:
MFCD11501319
IUPAC Name:
ethyl 3-pyridin-3-ylbenzoate
InChI:
InChI=1S/C14H13NO2/c1-2-17-14(16)12-6-3-5-11(9-12)13-7-4-8-15-10-13/h3-10H,2H2,1H3
InChI Key:
IHBQNWQTSYNXOJ-UHFFFAOYSA-N
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.263g/mol
Monoisotopic Mass:
227.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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