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24758-31-4 | Naphtho[2,1-b]furan-2-carboxylic acid, 1,2-dihydro-
CAS No: 24758-31-4 Catalog No: AG002PCY MDL No:MFCD03001250
Product Description
Catalog Number:
AG002PCY
Chemical Name:
Naphtho[2,1-b]furan-2-carboxylic acid, 1,2-dihydro-
CAS Number:
24758-31-4
Molecular Formula:
C13H10O3
Molecular Weight:
214.2167
MDL Number:
MFCD03001250
IUPAC Name:
1,2-dihydrobenzo[e][1]benzofuran-2-carboxylic acid
InChI:
InChI=1S/C13H10O3/c14-13(15)12-7-10-9-4-2-1-3-8(9)5-6-11(10)16-12/h1-6,12H,7H2,(H,14,15)
InChI Key:
VYFGHUAUIIFACL-UHFFFAOYSA-N
SMILES:
OC(=O)C1Oc2c(C1)c1ccccc1cc2
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.063g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.22g/mol
Monoisotopic Mass:
214.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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