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1353972-17-4 | 2-Cyclopropylamino-1-furan-2-yl-ethanone
CAS No: 1353972-17-4 Catalog No: AG01FBZ1 MDL No:
Product Description
Catalog Number:
AG01FBZ1
Chemical Name:
2-Cyclopropylamino-1-furan-2-yl-ethanone
CAS Number:
1353972-17-4
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
IUPAC Name:
2-(cyclopropylamino)-1-(furan-2-yl)ethanone
InChI:
InChI=1S/C9H11NO2/c11-8(6-10-7-3-4-7)9-2-1-5-12-9/h1-2,5,7,10H,3-4,6H2
InChI Key:
HMXYHJPSGGYQAS-UHFFFAOYSA-N
SMILES:
O=C(c1ccco1)CNC1CC1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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