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14003-16-8 | 2-Furanmethanamine, 5-methyl-
CAS No: 14003-16-8 Catalog No: AG001BYX MDL No:MFCD00143471
Product Description
Catalog Number:
AG001BYX
Chemical Name:
2-Furanmethanamine, 5-methyl-
CAS Number:
14003-16-8
Molecular Formula:
C6H9NO
Molecular Weight:
111.1418
MDL Number:
MFCD00143471
IUPAC Name:
(5-methylfuran-2-yl)methanamine
InChI:
InChI=1S/C6H9NO/c1-5-2-3-6(4-7)8-5/h2-3H,4,7H2,1H3
InChI Key:
YSEAGSCGERFGBL-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)CN
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.068g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
111.144g/mol
Monoisotopic Mass:
111.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
Literature
| Title | Journal |
|---|---|
| Chemistry in second life. | Chemistry Central journal 20090101 |
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