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128917-74-8 | Dodecanoic acid, 12-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS No: 128917-74-8 Catalog No: AG000YJI MDL No:MFCD00235888
Product Description
Catalog Number:
AG000YJI
Chemical Name:
Dodecanoic acid, 12-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS Number:
128917-74-8
Molecular Formula:
C27H35NO4
Molecular Weight:
437.5711
MDL Number:
MFCD00235888
IUPAC Name:
12-(9H-fluoren-9-ylmethoxycarbonylamino)dodecanoic acid
InChI:
InChI=1S/C27H35NO4/c29-26(30)18-8-6-4-2-1-3-5-7-13-19-28-27(31)32-20-25-23-16-11-9-14-21(23)22-15-10-12-17-24(22)25/h9-12,14-17,25H,1-8,13,18-20H2,(H,28,31)(H,29,30)
InChI Key:
HVGIKYAQSSNFCH-UHFFFAOYSA-N
SMILES:
O=C(OCC1c2ccccc2c2c1cccc2)NCCCCCCCCCCCC(=O)O
Properties
Complexity:
544
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
437.257g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
437.58g/mol
Monoisotopic Mass:
437.257g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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