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100079-23-0 | Benzamide, N-heptyl-3,4,5-trihydroxy-
CAS No: 100079-23-0 Catalog No: AG0000UL MDL No:
Product Description
Catalog Number:
AG0000UL
Chemical Name:
Benzamide, N-heptyl-3,4,5-trihydroxy-
CAS Number:
100079-23-0
Molecular Formula:
C14H21NO4
Molecular Weight:
267.3208
IUPAC Name:
N-heptyl-3,4,5-trihydroxybenzamide
InChI:
InChI=1S/C14H21NO4/c1-2-3-4-5-6-7-15-14(19)10-8-11(16)13(18)12(17)9-10/h8-9,16-18H,2-7H2,1H3,(H,15,19)
InChI Key:
LKNDXGONKWFJFY-UHFFFAOYSA-N
SMILES:
CCCCCCCNC(=O)c1cc(O)c(c(c1)O)O
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
267.325g/mol
Monoisotopic Mass:
267.147g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
89.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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