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7511-71-9 | 3-(dicyclohexylamino)propyl 4-aminobenzoate
CAS No: 7511-71-9 Catalog No: AG0056LA MDL No:
Product Description
Catalog Number:
AG0056LA
Chemical Name:
3-(dicyclohexylamino)propyl 4-aminobenzoate
CAS Number:
7511-71-9
Molecular Formula:
C22H34N2O2
Molecular Weight:
358.5176
IUPAC Name:
3-(dicyclohexylamino)propyl 4-aminobenzoate
InChI:
InChI=1S/C22H34N2O2/c23-19-14-12-18(13-15-19)22(25)26-17-7-16-24(20-8-3-1-4-9-20)21-10-5-2-6-11-21/h12-15,20-21H,1-11,16-17,23H2
InChI Key:
RYOAQAYVLLERES-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)N)OCCCN(C1CCCCC1)C1CCCCC1
NSC Number:
28633
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.262g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
358.526g/mol
Monoisotopic Mass:
358.262g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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