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72420-88-3 | 4H-1-Benzopyran-4-one, 6-chloro-2,3-dihydro-, oxime
CAS No: 72420-88-3 Catalog No: AG005HL3 MDL No:
Product Description
Catalog Number:
AG005HL3
Chemical Name:
4H-1-Benzopyran-4-one, 6-chloro-2,3-dihydro-, oxime
CAS Number:
72420-88-3
Molecular Formula:
C9H8ClNO2
Molecular Weight:
197.6183
IUPAC Name:
N-(6-chloro-2,3-dihydrochromen-4-ylidene)hydroxylamine
InChI:
InChI=1S/C9H8ClNO2/c10-6-1-2-9-7(5-6)8(11-12)3-4-13-9/h1-2,5,12H,3-4H2
InChI Key:
WISZZVZDRMFHFA-UHFFFAOYSA-N
SMILES:
ON=C1CCOc2c1cc(Cl)cc2
Properties
Complexity:
220
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:
1
Isotope Atom Count:
0
Molecular Weight:
197.618g/mol
Monoisotopic Mass:
197.024g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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