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882847-19-0 | Cyclohexaneacetic acid,1-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]methyl]-
CAS No: 882847-19-0 Catalog No: AG004A8S MDL No:MFCD04973795
Product Description
Catalog Number:
AG004A8S
Chemical Name:
Cyclohexaneacetic acid,1-[[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]methyl]-
CAS Number:
882847-19-0
Molecular Formula:
C24H27NO4
Molecular Weight:
393.4755
MDL Number:
MFCD04973795
IUPAC Name:
2-[1-[(9H-fluoren-9-ylmethoxycarbonylamino)methyl]cyclohexyl]acetic acid
InChI:
InChI=1S/C24H27NO4/c26-22(27)14-24(12-6-1-7-13-24)16-25-23(28)29-15-21-19-10-4-2-8-17(19)18-9-3-5-11-20(18)21/h2-5,8-11,21H,1,6-7,12-16H2,(H,25,28)(H,26,27)
InChI Key:
JQJOWILVGOJWJF-UHFFFAOYSA-N
SMILES:
OC(=O)CC1(CCCCC1)CNC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
563
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.194g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
393.483g/mol
Monoisotopic Mass:
393.194g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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