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Fmoc-D-allo-threoninol

CAT: 0121-4027547.0001Size: 1 gDry Ice: NoHazardous: No
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CAT#:0121-4027547.0001Size:1 g
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CAS Number
143143-54-8
Specifications
B-3075.0001
Sequence
Fmoc-D-allo-threoninol
Molecular Formula
C₁₉H₂₁NO₄
Molecular Weight
327.38
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

Fmoc-D-allo-threoninol
CAS Number143143-54-8
PubChem CID7006671
IUPAC Name9H-fluoren-9-ylmethyl N-[(2S,3R)-1,3-dihydroxybutan-2-yl]carbamate
Molecular FormulaC19H21NO4
Molecular Weight327.4
XLogP2.2
Topological Polar Surface Area78.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity408
SMILES
C[C@H]([C@H](CO)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13)O
InChI
InChI=1S/C19H21NO4/c1-12(22)18(10-21)20-19(23)24-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,12,17-18,21-22H,10-11H2,1H3,(H,20,23)/t12-,18+/m1/s1
InChIKey
YOKDHMTZJSRRIQ-XIKOKIGWSA-N
Chemical Structure
2D Structure
2D structure of Fmoc-D-allo-threoninol
CAS: 143143-54-8
CID: 7006671
Formula: C19H21NO4
MW: 327.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight327.4
XLogP32.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass327.14705815
Monoisotopic Mass327.14705815
Topological Polar Surface Area78.8 Ų
Heavy Atom Count24
Formal Charge0
Complexity408
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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