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Boc-cys (fm) -oh

CAT: 0127-OR963877-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR963877-01Size:1 g
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CAS Number
84888-35-7
MDL Number
MFCD00076921
Purity
98%
Smiles
CC(C)(C)OC(=O)N[C@@H](CSCC1c2ccccc2c3ccccc13)C(=O)O
Storage Conditions
Store at 2-8°C

Chemical Information

Boc-Cys(Fm)-OH
CAS Number84888-35-7
PubChem CID7018742
IUPAC Name(2R)-3-(9H-fluoren-9-ylmethylsulfanyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Molecular FormulaC22H25NO4S
Molecular Weight399.5
XLogP4.3
Topological Polar Surface Area101
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count28
Formal Charge0
Complexity539
SMILES
CC(C)(C)OC(=O)N[C@@H](CSCC1C2=CC=CC=C2C3=CC=CC=C13)C(=O)O
InChI
InChI=1S/C22H25NO4S/c1-22(2,3)27-21(26)23-19(20(24)25)13-28-12-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,23,26)(H,24,25)/t19-/m0/s1
InChIKey
AIZZGGDXFGAYMR-IBGZPJMESA-N
Chemical Structure
2D Structure
2D structure of Boc-Cys(Fm)-OH
CAS: 84888-35-7
CID: 7018742
Formula: C22H25NO4S
MW: 399.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.5
XLogP34.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass399.15042945
Monoisotopic Mass399.15042945
Topological Polar Surface Area101 Ų
Heavy Atom Count28
Formal Charge0
Complexity539
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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A-3435.0001Boc-Cys(Fm)-OH
443176-01Boc-cys (fm) -oh
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E-3070.0025H-Cys(Fm)-OH
4001680.0005(Boc-Cys-OH) ₂
sc-239393ABoc-Cys-OH
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