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1438-94-4 | 1H-Pyrrole, 1-(2-furanylmethyl)-
CAS No: 1438-94-4 Catalog No: AG001IEG MDL No:MFCD00010080
Product Description
Catalog Number:
AG001IEG
Chemical Name:
1H-Pyrrole, 1-(2-furanylmethyl)-
CAS Number:
1438-94-4
Molecular Formula:
C9H9NO
Molecular Weight:
147.1739
MDL Number:
MFCD00010080
IUPAC Name:
1-(furan-2-ylmethyl)pyrrole
InChI:
InChI=1S/C9H9NO/c1-2-6-10(5-1)8-9-4-3-7-11-9/h1-7H,8H2
InChI Key:
BTBFUBUCCJKJOZ-UHFFFAOYSA-N
SMILES:
c1ccn(c1)Cc1ccco1
EC Number:
215-876-1
UNII:
15HF30X204
FEMA Number:
3284
Properties
Complexity:
121
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.068g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.177g/mol
Monoisotopic Mass:
147.068g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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