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113387-10-3 | 1H-Pyrrole, 1-ethenyl-3-(3-furanyl)-
CAS No: 113387-10-3 Catalog No: AG0008DT MDL No:
Product Description
Catalog Number:
AG0008DT
Chemical Name:
1H-Pyrrole, 1-ethenyl-3-(3-furanyl)-
CAS Number:
113387-10-3
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
IUPAC Name:
1-ethenyl-3-(furan-3-yl)pyrrole
InChI:
InChI=1S/C10H9NO/c1-2-11-5-3-9(7-11)10-4-6-12-8-10/h2-8H,1H2
InChI Key:
HKZYYGYBKHHZAM-UHFFFAOYSA-N
SMILES:
C=Cn1ccc(c1)c1cocc1
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.068g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.188g/mol
Monoisotopic Mass:
159.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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