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285991-71-1 | Furo[3,4-c]pyridin-3(1H)-one, 4-chloro-1,1-dimethyl-
CAS No: 285991-71-1 Catalog No: AG002VSZ MDL No:MFCD16040003
Product Description
Catalog Number:
AG002VSZ
Chemical Name:
Furo[3,4-c]pyridin-3(1H)-one, 4-chloro-1,1-dimethyl-
CAS Number:
285991-71-1
Molecular Formula:
C9H8ClNO2
Molecular Weight:
197.6183
MDL Number:
MFCD16040003
IUPAC Name:
4-chloro-1,1-dimethylfuro[3,4-c]pyridin-3-one
InChI:
InChI=1S/C9H8ClNO2/c1-9(2)5-3-4-11-7(10)6(5)8(12)13-9/h3-4H,1-2H3
InChI Key:
SYUCKMHGOHWLJH-UHFFFAOYSA-N
SMILES:
O=C1OC(c2c1c(Cl)ncc2)(C)C
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.024g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.618g/mol
Monoisotopic Mass:
197.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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