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615-06-5 | Methyl 3-(furan-2-yl);-3-oxopropanoate
CAS No: 615-06-5 Catalog No: AG003RNY MDL No:MFCD03424758
Product Description
Catalog Number:
AG003RNY
Chemical Name:
Methyl 3-(furan-2-yl);-3-oxopropanoate
CAS Number:
615-06-5
Molecular Formula:
C8H8O4
Molecular Weight:
168.1467
MDL Number:
MFCD03424758
IUPAC Name:
methyl 3-(furan-2-yl)-3-oxopropanoate
InChI:
InChI=1S/C8H8O4/c1-11-8(10)5-6(9)7-3-2-4-12-7/h2-4H,5H2,1H3
InChI Key:
YGTDKZHHEPVYGJ-UHFFFAOYSA-N
SMILES:
COC(=O)CC(=O)c1ccco1
NSC Number:
21608
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.042g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.148g/mol
Monoisotopic Mass:
168.042g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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