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2-Fur-2-ylaniline

CAT: 0024-sc-259921ASize: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-259921ASize:1 g
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CAS Number
55578-79-5

Chemical Information

2-(Furan-2-yl)aniline
CAS Number55578-79-5
PubChem CID4685350
IUPAC Name2-(furan-2-yl)aniline
Molecular FormulaC10H9NO
Molecular Weight159.18
XLogP2
Topological Polar Surface Area39.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity149
SMILES
C1=CC=C(C(=C1)C2=CC=CO2)N
InChI
InChI=1S/C10H9NO/c11-9-5-2-1-4-8(9)10-6-3-7-12-10/h1-7H,11H2
InChIKey
RQBZXUOVNFIZGW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(Furan-2-yl)aniline
CAS: 55578-79-5
CID: 4685350
Formula: C10H9NO
MW: 159.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight159.18
XLogP32
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass159.068413911
Monoisotopic Mass159.068413911
Topological Polar Surface Area39.2 Ų
Heavy Atom Count12
Formal Charge0
Complexity149
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes