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805250-17-3 | Methyl 2-(6-hydroxy-2,3-dihydrobenzofuran-3-yl);acetate
CAS No: 805250-17-3 Catalog No: AG003RKZ MDL No:MFCD19703879
Product Description
Catalog Number:
AG003RKZ
Chemical Name:
Methyl 2-(6-hydroxy-2,3-dihydrobenzofuran-3-yl);acetate
CAS Number:
805250-17-3
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
MDL Number:
MFCD19703879
IUPAC Name:
methyl 2-(6-hydroxy-2,3-dihydro-1-benzofuran-3-yl)acetate
InChI:
InChI=1S/C11H12O4/c1-14-11(13)4-7-6-15-10-5-8(12)2-3-9(7)10/h2-3,5,7,12H,4,6H2,1H3
InChI Key:
RHMDISFJOKCCAQ-UHFFFAOYSA-N
SMILES:
COC(=O)CC1COc2c1ccc(c2)O
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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