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86060-81-3 | Fmoc-Cys(Acm)-OH
CAS No: 86060-81-3 Catalog No: AG0036F0 MDL No:MFCD00038769
Product Description
Catalog Number:
AG0036F0
Chemical Name:
Fmoc-Cys(Acm)-OH
CAS Number:
86060-81-3
Molecular Formula:
C21H22N2O5S
Molecular Weight:
414.4748
MDL Number:
MFCD00038769
IUPAC Name:
(2R)-3-(acetamidomethylsulfanyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid
InChI:
InChI=1S/C21H22N2O5S/c1-13(24)22-12-29-11-19(20(25)26)23-21(27)28-10-18-16-8-4-2-6-14(16)15-7-3-5-9-17(15)18/h2-9,18-19H,10-12H2,1H3,(H,22,24)(H,23,27)(H,25,26)/t19-/m0/s1
InChI Key:
CSMYOORPUGPKAP-IBGZPJMESA-N
SMILES:
CC(=O)NCSC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2c2c1cccc2
EC Number:
617-794-5
Properties
Complexity:
580
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
414.125g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
414.476g/mol
Monoisotopic Mass:
414.125g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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