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121880-45-3 | 2-Furancarbonyl chloride, 5-acetyl-
CAS No: 121880-45-3 Catalog No: AG0016BV MDL No:
Product Description
Catalog Number:
AG0016BV
Chemical Name:
2-Furancarbonyl chloride, 5-acetyl-
CAS Number:
121880-45-3
Molecular Formula:
C7H5ClO3
Molecular Weight:
172.5658
IUPAC Name:
5-acetylfuran-2-carbonyl chloride
InChI:
InChI=1S/C7H5ClO3/c1-4(9)5-2-3-6(11-5)7(8)10/h2-3H,1H3
InChI Key:
KPOMYWBBXHLZEF-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(o1)C(=O)Cl
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.993g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.564g/mol
Monoisotopic Mass:
171.993g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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