Home Carbonyls (2S)-2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-5-hexynoic acid

(2S)-2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-5-hexynoic acid

CAS No.:
942518-21-0
Catalog Number:
AG003AVD
Molecular Formula:
C21H19NO4
Molecular Weight:
349.3799
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Product Description
Catalog Number:
AG003AVD
Chemical Name:
(2S)-2-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-5-hexynoic acid
CAS Number:
942518-21-0
Molecular Formula:
C21H19NO4
Molecular Weight:
349.3799
MDL Number:
MFCD11052899
IUPAC Name:
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hex-5-ynoic acid
InChI:
InChI=1S/C21H19NO4/c1-2-3-12-19(20(23)24)22-21(25)26-13-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h1,4-11,18-19H,3,12-13H2,(H,22,25)(H,23,24)/t19-/m0/s1
InChI Key:
IISRBJULQYVYGV-IBGZPJMESA-N
SMILES:
C#CCC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
544  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
349.131g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
349.386g/mol
Monoisotopic Mass:
349.131g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties