methyl 6-chloro-3,4-dihydro-2H-chromene-3-carboxylate


Chemical Name: methyl 6-chloro-3,4-dihydro-2H-chromene-3-carboxylate
CAS Number: 68281-66-3
Product Number: AG005XEG(AGN-PC-02SQP3)
Synonyms:
MDL No:
Molecular Formula: C11H11ClO3
Molecular Weight: 226.6562

Identification/Properties


Computed Properties
Molecular Weight:
226.656g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
226.04g/mol
Monoisotopic Mass:
226.04g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
244
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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