Home Carboxys Methyl 6-fluorochroman-2-carboxylate

Methyl 6-fluorochroman-2-carboxylate

CAS No.:
874649-82-8
Catalog Number:
AG004FSD
Molecular Formula:
C11H11FO3
Molecular Weight:
210.2016
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Product Description
Catalog Number:
AG004FSD
Chemical Name:
Methyl 6-fluorochroman-2-carboxylate
CAS Number:
874649-82-8
Molecular Formula:
C11H11FO3
Molecular Weight:
210.2016
MDL Number:
MFCD09701969
IUPAC Name:
methyl 6-fluoro-3,4-dihydro-2H-chromene-2-carboxylate
InChI:
InChI=1S/C11H11FO3/c1-14-11(13)10-4-2-7-6-8(12)3-5-9(7)15-10/h3,5-6,10H,2,4H2,1H3
InChI Key:
QAYAXMIKHJVIJM-UHFFFAOYSA-N
SMILES:
COC(=O)C1CCc2c(O1)ccc(c2)F
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.204g/mol
Monoisotopic Mass:
210.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties