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1260903-12-5 | 1,2-Benzisoxazole, 7-broMo-5-chloro-
CAS No: 1260903-12-5 Catalog No: AG000RKZ MDL No:MFCD11847343
Product Description
Catalog Number:
AG000RKZ
Chemical Name:
1,2-Benzisoxazole, 7-broMo-5-chloro-
CAS Number:
1260903-12-5
Molecular Formula:
C7H3BrClNO
Molecular Weight:
232.4618
MDL Number:
MFCD11847343
IUPAC Name:
7-bromo-5-chloro-1,2-benzoxazole
InChI:
InChI=1S/C7H3BrClNO/c8-6-2-5(9)1-4-3-10-11-7(4)6/h1-3H
InChI Key:
HCDGSNNVDFZCJI-UHFFFAOYSA-N
SMILES:
Clc1cc(Br)c2c(c1)cno2
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.909g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.461g/mol
Monoisotopic Mass:
230.909g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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