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Home Carboxys 5-Oxo-[1,4]diazepane-1-carboxylic acid tert-butyl ester

5-Oxo-[1,4]diazepane-1-carboxylic acid tert-butyl ester

CAS No.:
190900-21-1
Catalog Number:
AG002EWN
Molecular Formula:
C10H18N2O3
Molecular Weight:
214.2615
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$32
- +
1g
>95%
In Stock USA
United States
$61
- +
5g
95%
In Stock USA
United States
$168
- +
10g
95%
In Stock USA
United States
$273
- +
25g
97%
In Stock USA
United States
$650
- +
Product Description
Catalog Number:
AG002EWN
Chemical Name:
5-Oxo-[1,4]diazepane-1-carboxylic acid tert-butyl ester
CAS Number:
190900-21-1
Molecular Formula:
C10H18N2O3
Molecular Weight:
214.2615
MDL Number:
MFCD04115319
IUPAC Name:
tert-butyl 5-oxo-1,4-diazepane-1-carboxylate
InChI:
InChI=1S/C10H18N2O3/c1-10(2,3)15-9(14)12-6-4-8(13)11-5-7-12/h4-7H2,1-3H3,(H,11,13)
InChI Key:
GLJYPTWEXBUATJ-UHFFFAOYSA-N
SMILES:
O=C1NCCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.132g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.265g/mol
Monoisotopic Mass:
214.132g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties