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74527-22-3 | 3(2H)-Benzoxazoleacetyl chloride, 2-oxo-
CAS No: 74527-22-3 Catalog No: AG005JDX MDL No:MFCD16652868
Product Description
Catalog Number:
AG005JDX
Chemical Name:
3(2H)-Benzoxazoleacetyl chloride, 2-oxo-
CAS Number:
74527-22-3
Molecular Formula:
C9H6ClNO3
Molecular Weight:
211.6018
MDL Number:
MFCD16652868
IUPAC Name:
2-(2-oxo-1,3-benzoxazol-3-yl)acetyl chloride
InChI:
InChI=1S/C9H6ClNO3/c10-8(12)5-11-6-3-1-2-4-7(6)14-9(11)13/h1-4H,5H2
InChI Key:
VFFIRNBFPYXJDF-UHFFFAOYSA-N
SMILES:
ClC(=O)Cn1c(=O)oc2c1cccc2
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.004g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.601g/mol
Monoisotopic Mass:
211.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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