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163426-01-5 | Benzamide, 4-chloro-N-[2-[4-(1-methylethoxy)phenyl]ethyl]-
CAS No: 163426-01-5 Catalog No: AG001U3I MDL No:
Product Description
Catalog Number:
AG001U3I
Chemical Name:
Benzamide, 4-chloro-N-[2-[4-(1-methylethoxy)phenyl]ethyl]-
CAS Number:
163426-01-5
Molecular Formula:
C18H20ClNO2
Molecular Weight:
317.8099
IUPAC Name:
4-chloro-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
InChI:
InChI=1S/C18H20ClNO2/c1-13(2)22-17-9-3-14(4-10-17)11-12-20-18(21)15-5-7-16(19)8-6-15/h3-10,13H,11-12H2,1-2H3,(H,20,21)
InChI Key:
PLNMITWQWWGXGE-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)CCNC(=O)c1ccc(cc1)Cl)C
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.118g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.813g/mol
Monoisotopic Mass:
317.118g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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