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  1. InChIKey:
  2. SMILES:
  3. Formula:
Amount Price  Help
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Guaranteed purity (%) Delivery time  Help
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1 mg 125 USD 90 17 working days Get Quote
5 mg 148 USD 90 17 working days Get Quote
10 mg 168 USD 90 17 working days Get Quote
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Name File
SDF P-25557229.sdf
SMILES P-25557229.smiles
Standard InChI P-25557229.inchi
InChIKey P-25557229.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-25557229 VITAS M CHEMICAL LIMITED Screening compounds 90 100 mg 7 hours ago
Property Value
Components 1
Mass 117.147
logP 1.75268
H-bond acceptors 1
H-bond donors 0
Rotatable bonds 1
PSA 23.79
RO5 violations 0
RO3 violations 0
Refractivity 35.964
Atoms 16
Rings 1
Heavy atoms 9
Hydrogen atoms 7
Heteroatoms 1
N/O atoms 1
Inorganic atoms 0
Halogen atoms 0
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