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209256-40-6 | 4-Benzofurancarboxylic acid, 2,3-dihydro-
CAS No: 209256-40-6 Catalog No: AG002K4P MDL No:MFCD10000604
Product Description
Catalog Number:
AG002K4P
Chemical Name:
4-Benzofurancarboxylic acid, 2,3-dihydro-
CAS Number:
209256-40-6
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD10000604
IUPAC Name:
2,3-dihydro-1-benzofuran-4-carboxylic acid
InChI:
InChI=1S/C9H8O3/c10-9(11)7-2-1-3-8-6(7)4-5-12-8/h1-3H,4-5H2,(H,10,11)
InChI Key:
CHDSHBWEGSCEDX-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1CCO2
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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