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14496-33-4 | 2-Furanmethanamine, N-ethyl-
CAS No: 14496-33-4 Catalog No: AG001KE9 MDL No:MFCD00069030
Product Description
Catalog Number:
AG001KE9
Chemical Name:
2-Furanmethanamine, N-ethyl-
CAS Number:
14496-33-4
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
MDL Number:
MFCD00069030
IUPAC Name:
N-(furan-2-ylmethyl)ethanamine
InChI:
InChI=1S/C7H11NO/c1-2-8-6-7-4-3-5-9-7/h3-5,8H,2,6H2,1H3
InChI Key:
CBVNYJPAGHUWKC-UHFFFAOYSA-N
SMILES:
CCNCc1ccco1
Properties
Complexity:
75.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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