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71971-00-1 | 4H-Furo[3,2-b]pyrrole-5-carboxylic acid, 2-phenyl-, ethyl ester
CAS No: 71971-00-1 Catalog No: AG005EDM MDL No:
Product Description
Catalog Number:
AG005EDM
Chemical Name:
4H-Furo[3,2-b]pyrrole-5-carboxylic acid, 2-phenyl-, ethyl ester
CAS Number:
71971-00-1
Molecular Formula:
C15H13NO3
Molecular Weight:
255.2686
IUPAC Name:
ethyl 2-phenyl-4H-furo[3,2-b]pyrrole-5-carboxylate
InChI:
InChI=1S/C15H13NO3/c1-2-18-15(17)12-9-14-11(16-12)8-13(19-14)10-6-4-3-5-7-10/h3-9,16H,2H2,1H3
InChI Key:
QCUOJQGCBZVOAP-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1[nH]c2c(c1)oc(c2)c1ccccc1
Properties
Complexity:
327
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.09g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.273g/mol
Monoisotopic Mass:
255.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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