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1260902-18-8 | 1,2-Benzisoxazol-3-amine, 6-iodo-
CAS No: 1260902-18-8 Catalog No: AG000RL3 MDL No:MFCD11847103
Product Description
Catalog Number:
AG000RL3
Chemical Name:
1,2-Benzisoxazol-3-amine, 6-iodo-
CAS Number:
1260902-18-8
Molecular Formula:
C7H5IN2O
Molecular Weight:
260.0319
MDL Number:
MFCD11847103
IUPAC Name:
6-iodo-1,2-benzoxazol-3-amine
InChI:
InChI=1S/C7H5IN2O/c8-4-1-2-5-6(3-4)11-10-7(5)9/h1-3H,(H2,9,10)
InChI Key:
DMBCXMCTHANKBN-UHFFFAOYSA-N
SMILES:
Ic1ccc2c(c1)onc2N
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.945g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.034g/mol
Monoisotopic Mass:
259.945g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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