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89345-05-1 | 2(3H)-Furanone, 5-butyl-3-chloro-5-ethyldihydro-
CAS No: 89345-05-1 Catalog No: AG003ZD1 MDL No:
Product Description
Catalog Number:
AG003ZD1
Chemical Name:
2(3H)-Furanone, 5-butyl-3-chloro-5-ethyldihydro-
CAS Number:
89345-05-1
Molecular Formula:
C10H17ClO2
Molecular Weight:
204.6938
IUPAC Name:
5-butyl-3-chloro-5-ethyloxolan-2-one
InChI:
InChI=1S/C10H17ClO2/c1-3-5-6-10(4-2)7-8(11)9(12)13-10/h8H,3-7H2,1-2H3
InChI Key:
DDHCAPKYILEOPT-UHFFFAOYSA-N
SMILES:
CCCCC1(CC)OC(=O)C(C1)Cl
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.092g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.694g/mol
Monoisotopic Mass:
204.092g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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