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189308-64-3 | 7-Benzofurancarbonyl chloride, 5-chloro-2,3-dihydro-2,2-dimethyl-
CAS No: 189308-64-3 Catalog No: AG002I97 MDL No:
Product Description
Catalog Number:
AG002I97
Chemical Name:
7-Benzofurancarbonyl chloride, 5-chloro-2,3-dihydro-2,2-dimethyl-
CAS Number:
189308-64-3
Molecular Formula:
C11H10Cl2O2
Molecular Weight:
245.1019
IUPAC Name:
5-chloro-2,2-dimethyl-3H-1-benzofuran-7-carbonyl chloride
InChI:
InChI=1S/C11H10Cl2O2/c1-11(2)5-6-3-7(12)4-8(10(13)14)9(6)15-11/h3-4H,5H2,1-2H3
InChI Key:
OJNHVYWIUHIOBS-UHFFFAOYSA-N
SMILES:
Clc1cc2CC(Oc2c(c1)C(=O)Cl)(C)C
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.006g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.099g/mol
Monoisotopic Mass:
244.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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