Home Carbonyls (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methyldodec-11-enoic acid

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methyldodec-11-enoic acid

CAS No.:
1640968-91-7
Catalog Number:
AG00HZ2T
Molecular Formula:
C28H35NO4
Molecular Weight:
449.5818
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Product Description
Catalog Number:
AG00HZ2T
Chemical Name:
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-methyldodec-11-enoic acid
CAS Number:
1640968-91-7
Molecular Formula:
C28H35NO4
Molecular Weight:
449.5818
MDL Number:
MFCD30471500
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-methyldodec-11-enoic acid
InChI:
InChI=1S/C28H35NO4/c1-3-4-5-6-7-8-9-14-19-28(2,26(30)31)29-27(32)33-20-25-23-17-12-10-15-21(23)22-16-11-13-18-24(22)25/h3,10-13,15-18,25H,1,4-9,14,19-20H2,2H3,(H,29,32)(H,30,31)/t28-/m0/s1
InChI Key:
NYZBBPVAHAVGKJ-NDEPHWFRSA-N
SMILES:
C=CCCCCCCCC[C@@](C(=O)O)(NC(=O)OCC1c2ccccc2c2c1cccc2)C
Properties
Complexity:
628  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
449.257g/mol
Formal Charge:
0
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
449.591g/mol
Monoisotopic Mass:
449.257g/mol
Rotatable Bond Count:
14  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4  
Properties