Loading ...
Get optimized quotes instantly for 35M+ unique compounds. Create a free account and start optimizing your compound procurement. Learn more »

UNKNOWN STEREO

P-524441074

Product Show structure
In order to add this molecule to a collection you have to create an account.   Sign up for free
  1. InChIKey:
  2. SMILES:
  3. Formula:
  1. Get quote for multiple compounds
  2. Get custom quote


Name File
SDF P-524441074.sdf
SMILES P-524441074.smiles
Standard InChI P-524441074.inchi
InChIKey P-524441074.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-524441074 Key Organics Biochemicals 97 unavailable Yesterday
Property Value
Components 2
Mass 492.518
logP 1.6452
H-bond acceptors 11
H-bond donors 4
Rotatable bonds 13
PSA 170.54
RO5 violations 1
RO3 violations 5
Refractivity 129.0661
Atoms 67
Rings 2
Heavy atoms 35
Hydrogen atoms 32
Heteroatoms 11
N/O atoms 11
Inorganic atoms 0
Halogen atoms 0
Chiral centers 3
R/S chiral centers 3
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
loader