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88699-35-8 | Ethanone, 1-[3-chloro-4-(diethylamino)-5-methoxyphenyl]-
CAS No: 88699-35-8 Catalog No: AG0046H1 MDL No:
Product Description
Catalog Number:
AG0046H1
Chemical Name:
Ethanone, 1-[3-chloro-4-(diethylamino)-5-methoxyphenyl]-
CAS Number:
88699-35-8
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
IUPAC Name:
1-[3-chloro-4-(diethylamino)-5-methoxyphenyl]ethanone
InChI:
InChI=1S/C13H18ClNO2/c1-5-15(6-2)13-11(14)7-10(9(3)16)8-12(13)17-4/h7-8H,5-6H2,1-4H3
InChI Key:
BQAHXIUYSHIJDB-UHFFFAOYSA-N
SMILES:
CCN(c1c(Cl)cc(cc1OC)C(=O)C)CC
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.103g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.742g/mol
Monoisotopic Mass:
255.103g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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