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MCULE-4467353796-0

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InChIKey:
SMILES:
InChI:
Formula:

Amount	Price Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.	Guaranteed purity (%)	Delivery time Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
1 mg	5 USD	99	8 working days	Get Quote
5 mg	5 USD	99	8 working days	Get Quote
10 mg	5 USD	99	8 working days	Get Quote

New customers are eligible for a 10% discount if indicated at the time of ordering.

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Name	File
SDF	MCULE-4467353796-0.sdf
SMILES	MCULE-4467353796-0.smiles
Standard InChI	MCULE-4467353796-0.inchi
InChIKey	MCULE-4467353796-0.txt

mcule product ID	Supplier	Catalog	Guaranteed purity (%)	Product matching	Availability
P-584627872	BLD pharm	In-stock building blocks	99	As a component	3.1 kg

Property	Value
Components	1
Mass	121.113
logP	0.0501
H-bond acceptors	2
H-bond donors	0
Rotatable bonds	1
PSA	40.13
RO5 violations	0
RO3 violations	0
Refractivity	31.459
Atoms	14
Rings	1
Heavy atoms	9
Hydrogen atoms	5
Heteroatoms	2
N/O atoms	2
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

MCULE-4467353796-0

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