Home Carboxys 1-tert-Butyl 4-ethyl azepane-1,4-dicarboxylate

1-tert-Butyl 4-ethyl azepane-1,4-dicarboxylate

CAS No.:
912444-90-7
Catalog Number:
AG00H0ZZ
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$144
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Product Description
Catalog Number:
AG00H0ZZ
Chemical Name:
1-tert-Butyl 4-ethyl azepane-1,4-dicarboxylate
CAS Number:
912444-90-7
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
MDL Number:
MFCD18088889
IUPAC Name:
1-O-tert-butyl 4-O-ethyl azepane-1,4-dicarboxylate
InChI:
InChI=1S/C14H25NO4/c1-5-18-12(16)11-7-6-9-15(10-8-11)13(17)19-14(2,3)4/h11H,5-10H2,1-4H3
InChI Key:
BGYFVOHWJYYBER-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCCN(CC1)C(=O)OC(C)(C)C
Properties
Complexity:
322  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.178g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.357g/mol
Monoisotopic Mass:
271.178g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties