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Fmoc-L-cysteic acid

CAT: 0024-sc-327803Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-327803Size:1 g
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CAS Number
751470-47-0

Chemical Information

N-((9H-Fluoren-9-ylmethoxy)carbonyl)-3-sulfo-L-alanine
CAS Number751470-47-0
PubChem CID46737376
IUPAC Name(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-sulfopropanoic acid
Molecular FormulaC18H17NO7S
Molecular Weight391.4
XLogP1.6
Topological Polar Surface Area138
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity637
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CS(=O)(=O)O)C(=O)O
InChI
InChI=1S/C18H17NO7S/c20-17(21)16(10-27(23,24)25)19-18(22)26-9-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-16H,9-10H2,(H,19,22)(H,20,21)(H,23,24,25)/t16-/m0/s1
InChIKey
BUTKUPGRCQCTTA-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of N-((9H-Fluoren-9-ylmethoxy)carbonyl)-3-sulfo-L-alanine
CAS: 751470-47-0
CID: 46737376
Formula: C18H17NO7S
MW: 391.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight391.4
XLogP31.6
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass391.07257305
Monoisotopic Mass391.07257305
Topological Polar Surface Area138 Ų
Heavy Atom Count27
Formal Charge0
Complexity637
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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