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305858-63-3 | Hexanoic acid, 6-[[4-(1-methylethoxy)benzoyl]amino]-
CAS No: 305858-63-3 Catalog No: AG0030M2 MDL No:MFCD00413371
Product Description
Catalog Number:
AG0030M2
Chemical Name:
Hexanoic acid, 6-[[4-(1-methylethoxy)benzoyl]amino]-
CAS Number:
305858-63-3
Molecular Formula:
C16H23NO4
Molecular Weight:
293.3581
MDL Number:
MFCD00413371
IUPAC Name:
6-[(4-propan-2-yloxybenzoyl)amino]hexanoic acid
InChI:
InChI=1S/C16H23NO4/c1-12(2)21-14-9-7-13(8-10-14)16(20)17-11-5-3-4-6-15(18)19/h7-10,12H,3-6,11H2,1-2H3,(H,17,20)(H,18,19)
InChI Key:
ADKUSKGEMZYATO-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1)C(=O)NCCCCCC(=O)O)C
Properties
Complexity:
322
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.163g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
293.363g/mol
Monoisotopic Mass:
293.163g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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