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306935-35-3 | Benzamide, 3-butoxy-4-methoxy-
CAS No: 306935-35-3 Catalog No: AG0030UI MDL No:MFCD00831076
Product Description
Catalog Number:
AG0030UI
Chemical Name:
Benzamide, 3-butoxy-4-methoxy-
CAS Number:
306935-35-3
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
MDL Number:
MFCD00831076
IUPAC Name:
3-butoxy-4-methoxybenzamide
InChI:
InChI=1S/C12H17NO3/c1-3-4-7-16-11-8-9(12(13)14)5-6-10(11)15-2/h5-6,8H,3-4,7H2,1-2H3,(H2,13,14)
InChI Key:
PUTAJFMTWWHQJO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OCCCC)C(=O)N
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.121g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.272g/mol
Monoisotopic Mass:
223.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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