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162648-54-6 | Cyclohexanecarboxylic acid, 1-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS No: 162648-54-6 Catalog No: AG001T9Y MDL No:MFCD00273464
Product Description
Catalog Number:
AG001T9Y
Chemical Name:
Cyclohexanecarboxylic acid, 1-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-
CAS Number:
162648-54-6
Molecular Formula:
C22H23NO4
Molecular Weight:
365.4223
MDL Number:
MFCD00273464
IUPAC Name:
1-(9H-fluoren-9-ylmethoxycarbonylamino)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C22H23NO4/c24-20(25)22(12-6-1-7-13-22)23-21(26)27-14-19-17-10-4-2-8-15(17)16-9-3-5-11-18(16)19/h2-5,8-11,19H,1,6-7,12-14H2,(H,23,26)(H,24,25)
InChI Key:
VCIVAWBKUQJNSX-UHFFFAOYSA-N
SMILES:
O=C(NC1(CCCCC1)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
535
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.163g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
365.429g/mol
Monoisotopic Mass:
365.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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