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856437-50-8 | Furan-3-ylmethyl-(tetrahydro-furan-2-ylmethyl)-amine
CAS No: 856437-50-8 Catalog No: AG01F8MS MDL No:
Product Description
Catalog Number:
AG01F8MS
Chemical Name:
Furan-3-ylmethyl-(tetrahydro-furan-2-ylmethyl)-amine
CAS Number:
856437-50-8
Molecular Formula:
C10H15NO2
Molecular Weight:
181.2316
IUPAC Name:
N-(furan-3-ylmethyl)-1-(oxolan-2-yl)methanamine
InChI:
InChI=1S/C10H15NO2/c1-2-10(13-4-1)7-11-6-9-3-5-12-8-9/h3,5,8,10-11H,1-2,4,6-7H2
InChI Key:
WBDDEGSGJCEMOY-UHFFFAOYSA-N
SMILES:
C1COC(C1)CNCc1cocc1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.11g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.235g/mol
Monoisotopic Mass:
181.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
34.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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