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13678-52-9 | 1H-Pyrrole, 1-[(5-methyl-2-furanyl)methyl]-
CAS No: 13678-52-9 Catalog No: AG0012D2 MDL No:
Product Description
Catalog Number:
AG0012D2
Chemical Name:
1H-Pyrrole, 1-[(5-methyl-2-furanyl)methyl]-
CAS Number:
13678-52-9
Molecular Formula:
C10H11NO
Molecular Weight:
161.2004
IUPAC Name:
1-[(5-methylfuran-2-yl)methyl]pyrrole
InChI:
InChI=1S/C10H11NO/c1-9-4-5-10(12-9)8-11-6-2-3-7-11/h2-7H,8H2,1H3
InChI Key:
CAHIUMOBCXFSCC-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)Cn1cccc1
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.204g/mol
Monoisotopic Mass:
161.084g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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