Home Other Building Blocks Ethanone, 1-(3-methyl-2-furanyl)-

Ethanone, 1-(3-methyl-2-furanyl)-

CAS No.:
13101-45-6
Catalog Number:
AG000VBV
Molecular Formula:
C7H8O2
Molecular Weight:
124.1372
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Product Description
Catalog Number:
AG000VBV
Chemical Name:
Ethanone, 1-(3-methyl-2-furanyl)-
CAS Number:
13101-45-6
Molecular Formula:
C7H8O2
Molecular Weight:
124.1372
MDL Number:
MFCD22392181
IUPAC Name:
1-(3-methylfuran-2-yl)ethanone
InChI:
InChI=1S/C7H8O2/c1-5-3-4-9-7(5)6(2)8/h3-4H,1-2H3
InChI Key:
RJBGVAIXGHZIDY-UHFFFAOYSA-N
SMILES:
CC(=O)c1occc1C
Properties
Complexity:
120  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.052g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.139g/mol
Monoisotopic Mass:
124.052g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties