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115538-83-5 | Benzeneacetamide, 4-(3-chloro-2-hydroxypropoxy)-
CAS No: 115538-83-5 Catalog No: AG000G4O MDL No:
Product Description
Catalog Number:
AG000G4O
Chemical Name:
Benzeneacetamide, 4-(3-chloro-2-hydroxypropoxy)-
CAS Number:
115538-83-5
Molecular Formula:
C11H14ClNO3
Molecular Weight:
243.6868
IUPAC Name:
2-[4-(3-chloro-2-hydroxypropoxy)phenyl]acetamide
InChI:
InChI=1S/C11H14ClNO3/c12-6-9(14)7-16-10-3-1-8(2-4-10)5-11(13)15/h1-4,9,14H,5-7H2,(H2,13,15)
InChI Key:
OQFMSHFNOSFLJU-UHFFFAOYSA-N
SMILES:
ClCC(COc1ccc(cc1)CC(=O)N)O
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
243.687g/mol
Monoisotopic Mass:
243.066g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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