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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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1 mg 62 USD 95 19 working days Get Quote
5 mg 62 USD 95 19 working days Get Quote
10 mg 62 USD 95 19 working days Get Quote
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Name File
SDF P-590359423.sdf
SMILES P-590359423.smiles
Standard InChI P-590359423.inchi
InChIKey P-590359423.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-590359423 AK Scientific Building Blocks 95 in stock November 4, 2019
Property Value
Components 1
Mass 205.038
logP 1.9853
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 3
PSA 41.99
RO5 violations 0
RO3 violations 0
Refractivity 48.3557
Atoms 18
Rings 1
Heavy atoms 12
Hydrogen atoms 6
Heteroatoms 5
N/O atoms 3
Inorganic atoms 0
Halogen atoms 2
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0