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Methyl (4S)-4-(tritylamino)cyclopent-1-ene-1-carboxylate

CAS No.:
1113025-21-0
Catalog Number:
AG008TMJ
Molecular Formula:
C26H25NO2
Molecular Weight:
383.4822
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Product Description
Catalog Number:
AG008TMJ
Chemical Name:
Methyl (4S)-4-(tritylamino)cyclopent-1-ene-1-carboxylate
CAS Number:
1113025-21-0
Molecular Formula:
C26H25NO2
Molecular Weight:
383.4822
MDL Number:
MFCD28167955
IUPAC Name:
methyl (4S)-4-(tritylamino)cyclopentene-1-carboxylate
InChI:
InChI=1S/C26H25NO2/c1-29-25(28)20-17-18-24(19-20)27-26(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-17,24,27H,18-19H2,1H3/t24-/m0/s1
InChI Key:
AOYXUIVZWKSQGP-DEOSSOPVSA-N
SMILES:
COC(=O)C1=CC[C@@H](C1)NC(c1ccccc1)(c1ccccc1)c1ccccc1
Properties
Complexity:
520  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
383.189g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
383.491g/mol
Monoisotopic Mass:
383.189g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Properties