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210-98-0 | Furo[2,3-e][1,2]benzisoxazole (8CI,9CI)
CAS No: 210-98-0 Catalog No: AG002KIH MDL No:MFCD27959097
Product Description
Catalog Number:
AG002KIH
Chemical Name:
Furo[2,3-e][1,2]benzisoxazole (8CI,9CI)
CAS Number:
210-98-0
Molecular Formula:
C9H5NO2
Molecular Weight:
159.1415
MDL Number:
MFCD27959097
IUPAC Name:
furo[2,3-e][1,2]benzoxazole
InChI:
InChI=1S/C9H5NO2/c1-2-8-7(5-10-12-8)9-6(1)3-4-11-9/h1-5H
InChI Key:
RMSXXPDDXINLRM-UHFFFAOYSA-N
SMILES:
n1oc2c(c1)c1occc1cc2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.032g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
159.144g/mol
Monoisotopic Mass:
159.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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