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AA02435

10045-45-1 | 1-Ethylbenzimidazolinone

Packsize Purity Availability Price Discounted Price    Quantity
5mg ≥98% In Stock US $86.00 $60.00 -   +
1g 98% In Stock US $93.00 $65.00 -   +
5g 98% In Stock US $333.00 $233.00 -   +
10g 98% In Stock US $532.00 $372.00 -   +
25g 98% In Stock US $1,115.00 $780.00 -   +

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*All prices are in USD.

Description
Catalog Number: AA02435
Chemical Name: 1-Ethylbenzimidazolinone
CAS Number: 10045-45-1
Molecular Formula: C9H10N2O
Molecular Weight: 162.1885
MDL Number: MFCD00005715
IUPAC Name: 3-ethyl-1H-benzimidazol-2-one
InChl: InChI=1S/C9H10N2O/c1-2-11-8-6-4-3-5-7(8)10-9(11)12/h3-6H,2H2,1H3,(H,10,12)
InChl Key: CXUCKELNYMZTRT-UHFFFAOYSA-N
SMILES: CCn1c(=O)[nH]c2c1cccc2

 

Computed Properties
Complexity: 193  
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 162.079g/mol
Formal Charge: 0
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0
Molecular Weight: 162.192g/mol
Monoisotopic Mass: 162.079g/mol
Rotatable Bond Count: 1  
Topological Polar Surface Area: 32.3A^2
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 1.1  

 

 

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